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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 of BMS-423526 ARGININE

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

Approval Year

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)
Preferred Name English
Code System Code Type Description
FDA UNII
NJ9KJK1DO4
Created by admin on Mon Mar 31 18:00:43 GMT 2025 , Edited by admin on Mon Mar 31 18:00:43 GMT 2025
PRIMARY
PUBCHEM
131801082
Created by admin on Mon Mar 31 18:00:43 GMT 2025 , Edited by admin on Mon Mar 31 18:00:43 GMT 2025
PRIMARY
CAS
380469-08-9
Created by admin on Mon Mar 31 18:00:43 GMT 2025 , Edited by admin on Mon Mar 31 18:00:43 GMT 2025
PRIMARY