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Details

Stereochemistry ABSOLUTE
Molecular Formula C31H27N3O4
Molecular Weight 505.5638
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BMS-593214

SMILES

[H][C@@]12CC3=C(C=CC=C3)[C@]1([H])C4=C(N[C@H]2C5=CC(OC)=C(O)C=C5C6=CC=C(C=C6)C(O)=O)C=CC(=C4)C(N)=N

InChI

InChIKey=UZOHOGNUODEPEP-USOMCTOXSA-N
InChI=1S/C31H27N3O4/c1-38-27-15-22(21(14-26(27)35)16-6-8-17(9-7-16)31(36)37)29-24-12-18-4-2-3-5-20(18)28(24)23-13-19(30(32)33)10-11-25(23)34-29/h2-11,13-15,24,28-29,34-35H,12H2,1H3,(H3,32,33)(H,36,37)/t24-,28-,29+/m1/s1

HIDE SMILES / InChI

Molecular Formula C31H27N3O4
Molecular Weight 505.5638
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:23:13 GMT 2023
Edited
by admin
on Sat Dec 16 09:23:13 GMT 2023
Record UNII
XD269G3O31
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BMS-593214
Common Name English
(1,1'-BIPHENYL)-4-CARBOXYLIC ACID, 2'-((6R,6AR,11BR)-2-(AMINOIMINOMETHYL)-6,6A,7,11B-TETRAHYDRO-5H-INDENO(2,1-C)QUINOLIN-6-YL)-5'-HYDROXY-4'-METHOXY-
Systematic Name English
Code System Code Type Description
FDA UNII
XD269G3O31
Created by admin on Sat Dec 16 09:23:13 GMT 2023 , Edited by admin on Sat Dec 16 09:23:13 GMT 2023
PRIMARY
CAS
1004551-40-9
Created by admin on Sat Dec 16 09:23:13 GMT 2023 , Edited by admin on Sat Dec 16 09:23:13 GMT 2023
PRIMARY
PUBCHEM
69249482
Created by admin on Sat Dec 16 09:23:13 GMT 2023 , Edited by admin on Sat Dec 16 09:23:13 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY