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Phyllolitorin

Also known as Pgltavgspm, Pglu-leu-trp-ala-val-gly-ser-phe-met-NH2, Ranatensin, 2-L-leucine-3-de-L-proline-4-de-L-glutamine-9-L-serine-

CAS 87734-77-8Formula C49H69N11O11SMolar mass 1,020.22 g/mol
Phyllolitorin chemical structure, C49H69N11O11S, CAS 87734-77-8
2D chemical structure

Key facts

What buyers check first

CAS number
87734-77-8
Formula
C49H69N11O11S
Molar mass
1,020.22 g/mol
HS code
293379
Category
Peptides

What is Phyllolitorin?

Plain description, key identifiers and synonyms

Phyllolitorin is a chemical substance with the molecular formula C49H69N11O11S and a molar mass of 1,020.22 g/mol. Its CAS registry number is 87734-77-8. The IUPAC name is (2S)-N-[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[2-[[(2S)-1-[[(2S)-1-[[(2S)-1-amino-4-methylsulfanyl-1-oxobutan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-3-methyl-1-oxobutan-2-yl]amino]-1-oxopropan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]-5-oxopyrrolidine-2-carboxamide.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(2S)-N-[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[2-[[(2S)-1-[[(2S)-1-[[(2S)-1-amino-4-methylsulfanyl-1-oxobutan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-3-methyl-1-oxobutan-2-yl]amino]-1-oxopropan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]-5-oxopyrrolidine-2-carboxamide
CAS number
87734-77-8 CAS number cross-checked
Molecular formula
C49H69N11O11S
InChIKey
UIMIJUUMRLISQI-CFFYGWOLSA-N
InChI
InChI=1S/C49H69N11O11S/c1-26(2)20-35(57-44(66)34-16-17-39(62)54-34)46(68)59-37(22-30-23-51-32-15-11-10-14-31(30)32)45(67)53-28(5)43(65)60-41(27(3)4)49(71)52-24-40(63)55-38(25-61)48(70)58-36(21-29-12-8-7-9-13-29)47(69)56-33(42(50)64)18-19-72-6/h7-15,23,26-28,33-38,41,51,61H,16-22,24-25H2,1-6H3,(H2,50,64)(H,52,71)(H,53,67)(H,54,62)(H,55,63)(H,56,69)(H,57,66)(H,58,70)(H,59,68)(H,60,65)/t28-,33-,34-,35-,36-,37-,38-,41-/m0/s1
Canonical SMILES
CSCCC(NC(=O)C(Cc1ccccc1)NC(=O)C(CO)NC(=O)CNC(=O)C(NC(=O)C(C)NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)C1CCC(=O)N1)C(C)C)C(N)=O
Isomeric SMILES
C[C@@H](C(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCSC)C(=O)N)NC(=O)[C@H](CC2=CNC3=CC=CC=C32)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]4CCC(=O)N4

Synonyms

  • Pgltavgspm
  • Pglu-leu-trp-ala-val-gly-ser-phe-met-NH2
  • Ranatensin, 2-L-leucine-3-de-L-proline-4-de-L-glutamine-9-L-serine-
  • 5-Oxo-L-prolyl-L-leucyl-L-tryptophyl-L-alanyl-L-valylglycyl-L-seryl-L-phenylalanyl-L-methioninamide

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
1,020.22 g/molcalc.
Exact mass
1,019.4899 Dacalc.
LogP (octanol/water)
-1.31calc.
Topological polar surface area
341 Ųcalc.
Hydrogen bond donors
12calc.
Hydrogen bond acceptors
12calc.
Rotatable bonds
28calc.
Heavy atoms
72calc.
Rings
4calc.
Aromatic rings
3calc.
Fraction sp3 carbons
0.51calc.
Formal charge
0calc.
Stereocentres
8calc.
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)CNC(=O)CNC(=O)CNC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)C1CCC(=O)N1)NCCc1ccccc1

O=C(CNC(=O)CNC(=O)CNC(=O)CNC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)C1CCC(=O)N1)NCCc1ccccc1

4 rings, 51 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.

Phyllolitorin suppliers

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Where suppliers are based

1 supplier in 1 country

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Phyllolitorin price

Indicative price range per kg from live supplier offers

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Uses and applications

What the substance is used for, by industry and function

Applications are not documented for this substance yet. Suppliers often describe uses on their product pages, linked in the suppliers list above.

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 Phyllolitorin is traded under.

HS 2933.79Indicative HS code

Lactams, other lactams

World exports in 2024
$16.2B
−64.4% vs 2023, imports $15.4B
2019 to 2024
Top exporters
  1. Ireland37.0%
  2. France * partner reported15.6%
  3. Spain11.3%
Top importers
  1. Germany27.8%
  2. Ireland18.9%
  3. Panama * partner reported12.9%

* Partner reported figures, a lower bound.

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

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

Frequently asked questions

Quick answers about Phyllolitorin, based on the data on this page

What is Phyllolitorin?

Phyllolitorin is a chemical substance with the molecular formula C49H69N11O11S and a molar mass of 1,020.22 g/mol. Its CAS registry number is 87734-77-8.

What is the CAS number of Phyllolitorin?

The CAS registry number of Phyllolitorin is 87734-77-8.

What is the molecular formula and weight of Phyllolitorin?

The molecular formula of Phyllolitorin is C49H69N11O11S and its molar mass is 1,020.22 g/mol.

Is Phyllolitorin hazardous?

No GHS hazard classification for Phyllolitorin 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 Phyllolitorin?

Phyllolitorin is usually classified under HS code 293379 (Lactams, other lactams). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Phyllolitorin?

CompoundList lists 1 supplier of Phyllolitorin in United States. Send one free request to get and compare quotes. Your contact details stay private until you accept a quote.

What is the price of Phyllolitorin?

Suppliers quote Phyllolitorin 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

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Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
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