IRI-426

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C31H47N9O8
Molecular Weight	673.7604
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(C)[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(C)=O)C(=O)N[C@@H](CC2=CC=CC=C2)C(N)=O

InChI

InChIKey=CBRZLECMSULEQH-AQBORDMYSA-N

InChI=1S/C31H47N9O8/c1-17(2)25(29(47)37-21(26(32)44)15-19-9-5-4-6-10-19)39-27(45)22(16-24(42)43)38-28(46)23-12-8-14-40(23)30(48)20(36-18(3)41)11-7-13-35-31(33)34/h4-6,9-10,17,20-23,25H,7-8,11-16H2,1-3H3,(H2,32,44)(H,36,41)(H,37,47)(H,38,46)(H,39,45)(H,42,43)(H4,33,34,35)/t20-,21-,22-,23-,25-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C31H47N9O8
Molecular Weight	673.7604
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	5 / 5
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 18:05:07 GMT 2025` Edited by `admin` on `Mon Mar 31 18:05:07 GMT 2025`
Record UNII	SEG3J6F5US
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

AC-ARG-PRO-ASP-VAL-PHE-NH2

Preferred Name

English

IRI-426

Code

English

L-PHENYLALANINAMIDE, N2-ACETYL-L-ARGINYL-L-PROLYL-L-.ALPHA.-ASPARTYL-L-VALYL-

Systematic Name

English

Code System Code Type Description

PUBCHEM

10462672

Created by admin on Mon Mar 31 18:05:07 GMT 2025 , Edited by admin on Mon Mar 31 18:05:07 GMT 2025

PRIMARY

FDA UNII

SEG3J6F5US

Created by admin on Mon Mar 31 18:05:07 GMT 2025 , Edited by admin on Mon Mar 31 18:05:07 GMT 2025

PRIMARY

CAS

103143-78-8

Created by admin on Mon Mar 31 18:05:07 GMT 2025 , Edited by admin on Mon Mar 31 18:05:07 GMT 2025

PRIMARY