CR-665 ACETATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C36H49N9O4.C2H4O2
Molecular Weight	731.8841
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(O)=O.CCCC[C@@H](NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@H](N)CC2=CC=CC=C2)C(=O)N[C@H](CCCNC(N)=N)C(=O)NCC3=CC=NC=C3

InChI

InChIKey=LBROLBBFPSFSKL-CKYFGSNBSA-N

InChI=1S/C36H49N9O4.C2H4O2/c1-2-3-15-30(34(48)43-29(16-10-19-41-36(38)39)33(47)42-24-27-17-20-40-21-18-27)44-35(49)31(23-26-13-8-5-9-14-26)45-32(46)28(37)22-25-11-6-4-7-12-25;1-2(3)4/h4-9,11-14,17-18,20-21,28-31H,2-3,10,15-16,19,22-24,37H2,1H3,(H,42,47)(H,43,48)(H,44,49)(H,45,46)(H4,38,39,41);1H3,(H,3,4)/t28-,29-,30-,31-;/m1./s1

HIDE SMILES / InChI

Molecular Formula	C36H49N9O4
Molecular Weight	671.8322
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Molecular Formula	C2H4O2
Molecular Weight	60.052
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Patents

Substance Class	Chemical Created by `admin` on `Fri Dec 15 19:29:42 GMT 2023` Edited by `admin` on `Fri Dec 15 19:29:42 GMT 2023`
Record UNII	S0O9V5HY48
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

CR-665 ACETATE

Code

English

D-ARGININAMIDE, D-PHENYLALANYL-D-PHENYLALANYL-D-NORLEUCYL-N-(4-PYRIDINYLMETHYL)-, ACETATE (1:1)

Systematic Name

English

FE-200665 ACETATE

Systematic Name

English

Code System Code Type Description

CAS

958873-83-1

Created by admin on Fri Dec 15 19:29:42 GMT 2023 , Edited by admin on Fri Dec 15 19:29:42 GMT 2023

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FDA UNII

S0O9V5HY48

Created by admin on Fri Dec 15 19:29:42 GMT 2023 , Edited by admin on Fri Dec 15 19:29:42 GMT 2023

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PUBCHEM

131634086

Created by admin on Fri Dec 15 19:29:42 GMT 2023 , Edited by admin on Fri Dec 15 19:29:42 GMT 2023

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