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Details

Stereochemistry ACHIRAL
Molecular Formula C24H26O3
Molecular Weight 362.4614
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of BMS-181156

SMILES

CC1(C)CCC(C)(C)C2=CC(=CC=C12)C(=O)\C=C\C3=CC=C(C=C3)C(O)=O

InChI

InChIKey=ZXQHMEUGMCXKLO-KPKJPENVSA-N
InChI=1S/C24H26O3/c1-23(2)13-14-24(3,4)20-15-18(10-11-19(20)23)21(25)12-7-16-5-8-17(9-6-16)22(26)27/h5-12,15H,13-14H2,1-4H3,(H,26,27)/b12-7+

HIDE SMILES / InChI

Molecular Formula C24H26O3
Molecular Weight 362.4614
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 18:53:56 GMT 2023
Edited
by admin
on Fri Dec 15 18:53:56 GMT 2023
Record UNII
C9FL8WH6S4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BMS-181156
Code English
BMS 181156
Code English
CH 80
Code English
BENZOIC ACID, 4-((1E)-3-OXO-3-(5,6,7,8-TETRAHYDRO-5,5,8,8-TETRAMETHYL-2-NAPHTHALENYL)-1-PROPEN-1-YL)-
Systematic Name English
CH-80
Code English
4-((1E)-3-OXO-3-(5,6,7,8-TETRAHYDRO-5,5,8,8-TETRAMETHYL-2-NAPHTHALENYL)-1-PROPEN-1-YL)BENZOIC ACID
Systematic Name English
Code System Code Type Description
CAS
95906-68-6
Created by admin on Fri Dec 15 18:53:56 GMT 2023 , Edited by admin on Fri Dec 15 18:53:56 GMT 2023
NON-SPECIFIC STEREOCHEMISTRY
DRUG BANK
DB02466
Created by admin on Fri Dec 15 18:53:56 GMT 2023 , Edited by admin on Fri Dec 15 18:53:56 GMT 2023
PRIMARY
PUBCHEM
445576
Created by admin on Fri Dec 15 18:53:56 GMT 2023 , Edited by admin on Fri Dec 15 18:53:56 GMT 2023
PRIMARY
CAS
110368-35-9
Created by admin on Fri Dec 15 18:53:56 GMT 2023 , Edited by admin on Fri Dec 15 18:53:56 GMT 2023
PRIMARY
FDA UNII
C9FL8WH6S4
Created by admin on Fri Dec 15 18:53:56 GMT 2023 , Edited by admin on Fri Dec 15 18:53:56 GMT 2023
PRIMARY
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