CompoundList

Elastatinal

Also known as Glutamamide, N-(((1-carboxy-3-methylbutyl)amino)carbonyl)glycyl-2-(2-amino-1,4,5,6-tetrahydro-4-pyrimidinyl)-N1-(1-methyl-2-oxoethyl)-, Elastatinal, microbial, Elastatinal (Standard)

CAS 51798-45-9Formula C21H36N8O7Molar mass 512.57 g/molEC 257-426-7
Elastatinal chemical structure, C21H36N8O7, CAS 51798-45-9
2D chemical structure

Key facts

What buyers check first

CAS number
51798-45-9
Formula
C21H36N8O7
Molar mass
512.57 g/mol
EC number
257-426-7
HS code
293359
Category
Peptides

What is Elastatinal?

Plain description, key identifiers and synonyms

Elastatinal has been reported in Actinomyces.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(2S)-2-[[(1S)-2-[[(2S)-5-amino-1,5-dioxo-1-[[(2S)-1-oxopropan-2-yl]amino]pentan-2-yl]amino]-1-[(4S)-2-amino-1,4,5,6-tetrahydropyrimidin-4-yl]-2-oxoethyl]carbamoylamino]-4-methylpentanoic acid
CAS number
51798-45-9
EC number
257-426-7
Molecular formula
C21H36N8O7
UNII
LX4Y75DOA7
InChIKey
IJWCGVPEDDQUDE-YGJAXBLXSA-N
InChI
InChI=1S/C21H36N8O7/c1-10(2)8-14(19(34)35)28-21(36)29-16(12-6-7-24-20(23)27-12)18(33)26-13(4-5-15(22)31)17(32)25-11(3)9-30/h9-14,16H,4-8H2,1-3H3,(H2,22,31)(H,25,32)(H,26,33)(H,34,35)(H3,23,24,27)(H2,28,29,36)/t11-,12-,13-,14-,16-/m0/s1
Canonical SMILES
CC(C)CC(NC(=O)NC(C(=O)NC(CCC(N)=O)C(=O)NC(C)C=O)C1CCNC(N)=N1)C(=O)O
Isomeric SMILES
C[C@@H](C=O)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H]([C@@H]1CCNC(=N1)N)NC(=O)N[C@@H](CC(C)C)C(=O)O

Synonyms

  • Glutamamide, N-(((1-carboxy-3-methylbutyl)amino)carbonyl)glycyl-2-(2-amino-1,4,5,6-tetrahydro-4-pyrimidinyl)-N1-(1-methyl-2-oxoethyl)-
  • Elastatinal, microbial
  • Elastatinal (Standard)
  • L-2-(2-Amino-1,4,5,6-tetrahydro-4-pyrimidinyl)-N-(((1-carboxy-3-methylbutyl)amino)carbonyl)glycyl-N1-(1-methyl-2-oxoethyl)-L-glutamamide, stereoisomer
  • L-Glutamamide, L-2-(2-amino-1,4,5,6-tetrahydro-4-pyrimidinyl-N-(((1-carboxy-3-methylbutyl)amino)carbonyl)glycyl-N(sup 1)-(1-methyl-2-oxoethyl)-, stereoisomer
  • (2S)-2-((4S)-2-Amino-3,4,5,6-tetrahydro-4-pyrimidinyl)-N-((((1S)-1-carboxy-3-methylbutyl)amino)carbonyl)glycyl-n1-((1S)-1-methyl-2-oxoethyl)-l-glutamamide
  • L-Glutamamide, (2S)-2-((4S)-2-amino-3,4,5,6-tetrahydro-4-pyrimidinyl)-N-((((1S)-1-carboxy-3-methylbutyl)amino)carbonyl)glycyl-n1-((1S)-1-methyl-2-oxoethyl)-

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
512.57 g/molcalc.
Exact mass
512.2707 Dacalc.
LogP (octanol/water)
-2.72calc.
Topological polar surface area
247.2 ร…ยฒcalc.
Hydrogen bond donors
8calc.
Hydrogen bond acceptors
9calc.
Rotatable bonds
14calc.
Heavy atoms
36calc.
Rings
1calc.
Aromatic rings
0calc.
Fraction sp3 carbons
0.67calc.
Formal charge
0calc.
Stereocentres
5calc.
Lipinski rule of five
Fails (2 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, C1=NCCCN1

C1=NCCCN1

1 ring, 6 atoms, the 1,4,5,6-Tetrahydropyrimidine ring system.

194 other chemicals share 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.

Elastatinal suppliers

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All 2 suppliers

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Where suppliers are based

2 suppliers in 1 country

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Elastatinal price

Indicative price range per kg from live supplier offers

No published prices right now

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Uses and applications

What the substance is used for, by industry and function

Pharmacological actions

  • Enzyme Inhibitors

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 Elastatinal is traded under.

HS 2933.59Indicative HS code

Compounds containing a pyrimidine ring (whether or not hydrogenated) or piperazine ring, other

World exports in 2024
$18.4B
+10.5% vs 2023, imports $24.8B
2019 to 2024
Top exporters
  1. Ireland43.6%
  2. Switzerland * partner reported26.3%
  3. China7.9%
Top importers
  1. Slovenia30.3%
  2. United States30.1%
  3. Germany15.3%

* Partner reported figures, a lower bound.

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

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

Frequently asked questions

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

What is Elastatinal?

Elastatinal has been reported in Actinomyces.

What is the CAS number of Elastatinal?

The CAS registry number of Elastatinal is 51798-45-9.

What is the molecular formula and weight of Elastatinal?

The molecular formula of Elastatinal is C21H36N8O7 and its molar mass is 512.57 g/mol.

What is Elastatinal used for?

Known uses and roles of Elastatinal include biochemical and pharmacological tools in research and laboratory and enzyme inhibitors.

Is Elastatinal hazardous?

No GHS hazard classification for Elastatinal 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 Elastatinal?

Elastatinal is usually classified under HS code 293359 (Compounds containing a pyrimidine ring (whether or not hydrogenated) or piperazine ringโ€ฆ). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Elastatinal?

CompoundList lists 2 suppliers of Elastatinal in Japan. Send one free request to get and compare quotes. Your contact details stay private until you accept a quote.

What is the price of Elastatinal?

Suppliers quote Elastatinal 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 Elastatinal

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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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