CompoundList
Sign in
Peptides

Cgp 42112A

Also known as Nicotinic acid-tyr-(N(sigma)-benzyloxycarbonyl-arg)lys-his-pro-ile-OH, L-Isoleucine, N-(1-(N-(N6-(N2-((phenylmethoxy)carbonyl)-L-arginyl)-N2-(N-(3-pyridinylcarbonyl)-L-tyrosyl)-L-lysyl)-L-histidyl)-L-prolyl)-, Cgp 42112

CAS 127060-75-7Formula C52H69N13O11Molar mass 1,052.20 g/mol
1 supplier listed
Get quotes See the supplier
Cgp 42112A chemical structure, C52H69N13O11, CAS 127060-75-7
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
127060-75-7
Formula
C52H69N13O11
Molar mass
1,052.20 g/mol
HS code
293339
Category
Peptides

What is Cgp 42112A?

Plain description, key identifiers and synonyms

CGP-42112A is a hexapeptide consisting of L-tyrosine, L-lysine, L-histidine, L-proline and L-isoleucine amino acid residues coupled in sequence and in which the amino group of the L-tyrosyl residue is substituted by a (pyridin-3-ylcarbonyl)nitrilo group and in which the L-lysyl side chain amino group is substituted by a {N2-[(benzyloxy)carbonyl]-L-arginyl}nitrilo group. It is a potent angiotensin II receptor type 2 (AT2 receptor) agonist. It has a role as an angiotensin receptor agonist, an antineoplastic agent, a vasodilator agent, a neuroprotective agent and an anti-inflammatory agent. It is a pyridinecarboxamide, an oligopeptide and a benzyl ester.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(2S,3S)-2-[[(2S)-1-[(2S)-2-[[(2S)-6-[[(2S)-5-(diaminomethylideneamino)-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-2-[[(2S)-3-(4-hydroxyphenyl)-2-(pyridine-3-carbonylamino)propanoyl]amino]hexanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]pyrrolidine-2-carbonyl]amino]-3-methylpentanoic acid
CAS number
127060-75-7 CAS number cross-checked
Molecular formula
C52H69N13O11
UNII
9Q3V7W3XDD
MDL number
MFCD00133611
InChIKey
UXGNARZDONUMMK-LRMQDCNJSA-N
InChI
InChI=1S/C52H69N13O11/c1-3-32(2)43(50(73)74)64-48(71)42-17-11-25-65(42)49(72)41(27-36-29-56-31-59-36)62-46(69)39(60-47(70)40(26-33-18-20-37(66)21-19-33)61-44(67)35-14-9-22-55-28-35)15-7-8-23-57-45(68)38(16-10-24-58-51(53)54)63-52(75)76-30-34-12-5-4-6-13-34/h4-6,9,12-14,18-22,28-29,31-32,38-43,66H,3,7-8,10-11,15-17,23-27,30H2,1-2H3,(H,56,59)(H,57,68)(H,60,70)(H,61,67)(H,62,69)(H,63,75)(H,64,71)(H,73,74)(H4,53,54,58)/t32-,38-,39-,40-,41-,42-,43-/m0/s1
Canonical SMILES
CCC(C)C(NC(=O)C1CCCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C(CCCCNC(=O)C(CCCN=C(N)N)NC(=O)OCc1ccccc1)NC(=O)C(Cc1ccc(O)cc1)NC(=O)c1cccnc1)C(=O)O
Isomeric SMILES
CC[C@H](C)[C@@H](C(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC2=CN=CN2)NC(=O)[C@H](CCCCNC(=O)[C@H](CCCN=C(N)N)NC(=O)OCC3=CC=CC=C3)NC(=O)[C@H](CC4=CC=C(C=C4)O)NC(=O)C5=CN=CC=C5

Synonyms

  • Nicotinic acid-tyr-(N(sigma)-benzyloxycarbonyl-arg)lys-his-pro-ile-OH
  • L-Isoleucine, N-(1-(N-(N6-(N2-((phenylmethoxy)carbonyl)-L-arginyl)-N2-(N-(3-pyridinylcarbonyl)-L-tyrosyl)-L-lysyl)-L-histidyl)-L-prolyl)-
  • Cgp 42112
  • Cgp 42112B
  • Angiotensin II Receptor Ligand
  • Nicotinic acid-tyrosyl-(N(sigma)-benzyloxycarbonyl-arginyl)lysyl-histidyl-prolyl-isoleucine-OH
  • [125I]CGP42112
  • [125I]-CGP42112
  • AngiotensinIIReceptorLigand
  • Nalpha-Nicotinoyl-Tyr-(Nalpha-Cbz-Arg)-Lys-His-Pro-Ile
  • PDSP1_000402
  • PDSP2_000400
  • CGP-42112?
  • N6-(((benzyloxy)carbonyl)-L-arginyl)-N2-(nicotinoyl-L-tyrosyl)-L-lysyl-L-histidyl-L-prolyl-L-isoleucine
  • CGP-42112A, >=95%, synthetic, solid
  • Nicotinoyl-Tyr-(6-(Cbz-Arg))Lys-His-Pro-Ile-OH
  • Angiotensin II Receptor Ligand Nicotinoyl-Tyr-Lys(Z-Arg)-His-Pro-Ile-OH
  • Nic-Tyr-Lys(Z-Arg)-His-Pro-Ile (Nic-nicotinoyl, Z- phenylmethoxy)carbonyl)
  • Angiotensin II Receptor Ligand (Nicotinoyl-Tyr-Lys(1)-His-Pro-Ile-OH.CbZ-Arg-(1))
  • L-Isoleucine, N-(3-pyridinylcarbonyl)-l-tyrosyl-n6-(n2-((phenylmethoxy)carbonyl)-l-arginyl)-l-lysyl-l-histidyl-l-prolyl-
  • N(6)-[[(phenylmethoxy)carbonyl]-L-Arg-]-N(2)-[[(pyridin-3-yl)carbonyl]-L-Tyr-]-L-Lys-L-His-L-Pro-L-Ile-OH
  • N(6)-{N(2)-[(benzyloxy)carbonyl]-L-arginyl}-N(2)-[N-(pyridin-3-ylcarbonyl)-L-tyrosyl]-L-lysyl-L-histidyl-L-prolyl-L-isoleucine
  • N(6)-{N(2)-[(benzyloxy)carbonyl]-L-arginyl}-N(2)-[N-(pyridine-3-carbonyl)-L-tyrosyl]-L-lysyl-L-histidyl-L-prolyl-L-isoleucine
  • N-(3-Pyridinylcarbonyl)-l-tyrosyl-n6-(n2-((phenylmethoxy)carbonyl)-l-arginyl)-l-lysyl-l-histidyl-l-prolyl-l-isoleucine
  • N-(3-Pyridinylcarbonyl)-L-tyrosyl-N6-[N2-[(phenylmethoxy )carbonyl]-L-arginyl]-L-lysyl-L-histidyl-L-prolyl-L-isoleucine
Show all 26 synonyms
  • N~6~-{N~2~-[(Benzyloxy)carbonyl]-N~5~-(diaminomethylidene)-L-ornithyl}-N~2~-[N-(pyridine-3-carbonyl)-L-tyrosyl]-L-lysyl-L-histidyl-L-prolyl-L-isoleucine

Physical and chemical properties

Measured values and descriptors computed from the structure

Physical and chemical properties

Measured values, check the supplier specification for your grade

No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.

Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.

Computed descriptors

Calculated from the structure, useful for screening and formulation

Molecular weight
1,052.20 g/molcalc.
Exact mass
1,051.524 Dacalc.
LogP (octanol/water)
1.31calc.
Topological polar surface area
367.6 Ųcalc.
Hydrogen bond donors
11calc.
Hydrogen bond acceptors
13calc.
Rotatable bonds
29calc.
Heavy atoms
76calc.
Rings
5calc.
Aromatic rings
4calc.
Fraction sp3 carbons
0.44calc.
Formal charge
0calc.
Stereocentres
7calc.
Lipinski rule of five
Fails (3 violations)calc.

Calculated for screening. Confirm critical figures with the supplier.

Murcko scaffold

The ring system that remains when every side chain is removed

Murcko scaffold of this chemical, O=C(CNC(=O)OCc1ccccc1)NCCCCC(NC(=O)C(Cc1ccccc1)NC(=O)c1cccnc1)C(=O)NC(Cc1cnc[nH]1)C(=O)N1CCCC1

O=C(CNC(=O)OCc1ccccc1)NCCCCC(NC(=O)C(Cc1ccccc1)NC(=O)c1cccnc1)C(=O)NC(Cc1cnc[nH]1)C(=O)N1CCCC1

5 rings, 57 atoms.

No other chemical in our database has this scaffold.

Safety and hazards

GHS classification summary, not a safety data sheet

No GHS hazard classification is recorded for this substance yet. That does not mean it is harmless.

GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.

Cgp 42112A suppliers

Sponsored listings first, then the documented ranking: membership, verification, replies, completeness, freshness and ratings

See the supplier

Suppliers marked Unclaimed profile have not claimed their profile yet. They are not verified by CompoundList, their offers are price on request and details may have changed, so please confirm them with the supplier. Company representatives can claim a profile with a business email on the company's own website domain. Our team verifies each claim and sends the result by email.

Where suppliers are based

1 supplier in 1 country

Send one request to many suppliers

Choose up to 10 suppliers or let us match your request. Compare quotes side by side, free.

Choose suppliersPost a request

Cgp 42112A price

Indicative price range per kg from live supplier offers

No published prices right now

Suppliers quote this chemical on request. Send one free request and compare quotes side by side.

Get latest price

Uses and applications

What the substance is used for, by industry and function

Roles

  • agonist
  • angiotensin receptor agonist
  • anti-inflammatory agent
  • antineoplastic agent
  • cardiovascular drug
  • hormone agonist
  • hormone receptor modulator
  • neuroprotective agent
  • pharmaceutical
  • protective agent
  • receptor modulator
  • vasodilator agent

Regulatory status

Inventories, regulations and trade controls that list this substance

No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.

HS code and trade data

Customs classification and reported world trade statistics

Global trade

World import and export statistics for the HS code Cgp 42112A is traded under.

HS 2933.39Indicative HS code

Heterocyclic compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure…

World exports in 2024
$9.16B
−17.9% vs 2023, imports $10.6B
2019 to 2024
Top exporters
  1. China21.5%
  2. India * partner reported12.3%
  3. Ireland11.6%
Top importers
  1. Germany14.2%
  2. United States12.8%
  3. Brazil10.1%

* Partner reported figures, a lower bound.

Reported customs values in USD, not prices.Full trade data

The HS code shown for Cgp 42112A is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Cgp 42112A, based on the data on this page

What is Cgp 42112A?

CGP-42112A is a hexapeptide consisting of L-tyrosine, L-lysine, L-histidine, L-proline and L-isoleucine amino acid residues coupled in sequence and in which the amino group of the L-tyrosyl residue is substituted by a (pyridin-3-ylcarbonyl)nitrilo group and in which the L-lysyl side chain amino group is substituted by…

What is the CAS number of Cgp 42112A?

The CAS registry number of Cgp 42112A is 127060-75-7.

What is the molecular formula and weight of Cgp 42112A?

The molecular formula of Cgp 42112A is C52H69N13O11 and its molar mass is 1,052.20 g/mol.

What is Cgp 42112A used for?

Known uses and roles of Cgp 42112A include building blocks in research and laboratory, agonist, angiotensin receptor agonist, anti-inflammatory agent, antineoplastic agent and 8 more.

Is Cgp 42112A hazardous?

No GHS hazard classification for Cgp 42112A is recorded on CompoundList yet. That does not prove it is safe. Always read the supplier safety data sheet.

What is the HS code of Cgp 42112A?

Cgp 42112A is usually classified under HS code 293339 (Compounds containing an unfused pyridine ring (whether or not hydrogenated) in the…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Cgp 42112A?

CompoundList lists 1 supplier of Cgp 42112A in China. Send one free request to get and compare quotes. Your contact details stay private until you accept a quote.

What is the price of Cgp 42112A?

Suppliers quote Cgp 42112A on request because prices depend on grade, purity, quantity and destination. A free request on CompoundList gets you several quotes to compare.

Guides for buyers

Practical guides that help when you source, ship or handle Cgp 42112A

Get quotes for Cgp 42112A

Post one free request with your grade, quantity and destination. Matching suppliers send quotes you can compare side by side.
Post a request Sell Cgp 42112A
Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
Embed this structure on your websiteShow code

Paste this code into your page to show the 2D structure of Cgp 42112A with a 3D view, its CAS number where known and a link back to this page. Free to use with the link kept.

<iframe src="https://www.compoundlist.com/embed/structure/cgp-42112a-127060-75-7" title="Cgp 42112A structure on CompoundList" width="360" height="420" style="border:1px solid #E7E2DA;border-radius:12px;max-width:100%" loading="lazy" referrerpolicy="strict-origin-when-cross-origin"></iframe>
Preview the embed

Explore more in Peptides or HS code 293339

1 supplier
Free quotes, contact stays private
Get quotes