BMS-423526 ARGININE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C30H32FNO4.C6H14N4O2
Molecular Weight	663.7787
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

N[C@@H](CCCNC(N)=N)C(O)=O.CC(C)C1=C(\C=C\[C@@H](O)C[C@@H](O)CC(O)=O)C(C2=CC=C(F)C=C2)=C3CCCC4=CC=CC=C4C3=N1

InChI

InChIKey=HZNYMNMMEDLICN-JGAMZNNKSA-N

InChI=1S/C30H32FNO4.C6H14N4O2/c1-18(2)29-26(15-14-22(33)16-23(34)17-27(35)36)28(20-10-12-21(31)13-11-20)25-9-5-7-19-6-3-4-8-24(19)30(25)32-29;7-4(5(11)12)2-1-3-10-6(8)9/h3-4,6,8,10-15,18,22-23,33-34H,5,7,9,16-17H2,1-2H3,(H,35,36);4H,1-3,7H2,(H,11,12)(H4,8,9,10)/b15-14+;/t22-,23-;4-/m10/s1

HIDE SMILES / InChI

Molecular Formula	C30H32FNO4
Molecular Weight	489.5778
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	1
Optical Activity	UNSPECIFIED

Molecular Formula	C6H14N4O2
Molecular Weight	174.201
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:32:46 GMT 2023` Edited by `admin` on `Fri Dec 15 15:32:46 GMT 2023`
Record UNII	NJ9KJK1DO4
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

BMS-423526 ARGININE

Code

English

L-ARGININE, MONO((3R,5S,6E)-7-(4-(4-FLUOROPHENYL)-6,7-DIHYDRO-2-(1-METHYLETHYL)-5H-BENZO(6,7)CYCLOHEPTA(1,2-B)PYRIDIN-3-YL)-3,5-DIHYDROXY-6-HEPTENOATE)

Systematic Name

English

Code System Code Type Description

FDA UNII

NJ9KJK1DO4

Created by admin on Fri Dec 15 15:32:47 GMT 2023 , Edited by admin on Fri Dec 15 15:32:47 GMT 2023

PRIMARY

PUBCHEM

131801082

Created by admin on Fri Dec 15 15:32:47 GMT 2023 , Edited by admin on Fri Dec 15 15:32:47 GMT 2023

PRIMARY

CAS

380469-08-9

Created by admin on Fri Dec 15 15:32:46 GMT 2023 , Edited by admin on Fri Dec 15 15:32:46 GMT 2023

PRIMARY

Related Record Type Details


					8G7XC143NZ

BMS-423526 FREE BASE

PARENT -> SALT/SOLVATE