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Details

Stereochemistry ABSOLUTE
Molecular Formula C27H29N3O5
Molecular Weight 475.5363
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BMS-986310

SMILES

CC(C)NC(=O)C1=CC=C2OCC[C@]3(C[C@H]3C(=O)NC4=CC(=CC=C4CCCC(O)=O)C#N)C2=C1

InChI

InChIKey=QSRLBYGDVFRMPT-IDISGSTGSA-N
InChI=1S/C27H29N3O5/c1-16(2)29-25(33)19-8-9-23-20(13-19)27(10-11-35-23)14-21(27)26(34)30-22-12-17(15-28)6-7-18(22)4-3-5-24(31)32/h6-9,12-13,16,21H,3-5,10-11,14H2,1-2H3,(H,29,33)(H,30,34)(H,31,32)/t21-,27-/m0/s1

HIDE SMILES / InChI

Molecular Formula C27H29N3O5
Molecular Weight 475.5363
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 14:12:39 UTC 2023
Edited
by admin
on Sat Dec 16 14:12:39 UTC 2023
Record UNII
VJ3OXN6K2H
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BMS-986310
Code English
ONO-4578
Code English
BENZENEBUTANOIC ACID, 4-CYANO-2-((((1'S,2'R)-2,3-DIHYDRO-6-(((1-METHYLETHYL)AMINO)CARBONYL)SPIRO(4H-1-BENZOPYRAN-4,1'-CYCLOPROPAN)-2'-YL)CARBONYL)AMINO)-
Systematic Name English
Code System Code Type Description
CAS
1965316-82-8
Created by admin on Sat Dec 16 14:12:40 UTC 2023 , Edited by admin on Sat Dec 16 14:12:40 UTC 2023
PRIMARY
FDA UNII
VJ3OXN6K2H
Created by admin on Sat Dec 16 14:12:40 UTC 2023 , Edited by admin on Sat Dec 16 14:12:40 UTC 2023
PRIMARY
PUBCHEM
121481566
Created by admin on Sat Dec 16 14:12:40 UTC 2023 , Edited by admin on Sat Dec 16 14:12:40 UTC 2023
PRIMARY
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