U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C32H48O5
Molecular Weight 512.7205
Optical Activity UNSPECIFIED
Defined Stereocenters 11 / 11
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3.BETA.-ACETYL-11-KETO-.BETA.-BOSWELLIC ACID

SMILES

[H][C@@]12CC[C@]3(C)[C@]([H])(C(=O)C=C4[C@]5([H])[C@@H](C)[C@H](C)CC[C@]5(C)CC[C@@]34C)[C@@]1(C)CC[C@H](OC(C)=O)[C@]2(C)C(O)=O

InChI

InChIKey=HMMGKOVEOFBCAU-GOBAHYPASA-N
InChI=1S/C32H48O5/c1-18-9-12-28(4)15-16-30(6)21(25(28)19(18)2)17-22(34)26-29(5)13-11-24(37-20(3)33)32(8,27(35)36)23(29)10-14-31(26,30)7/h17-19,23-26H,9-16H2,1-8H3,(H,35,36)/t18-,19+,23-,24+,25+,26-,28-,29+,30-,31-,32-/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
3.BETA.-ACETYL-11-KETO-.BETA.-BOSWELLIC ACID
Common Name English
URS-12-EN-23-OIC ACID, 3-(ACETYLOXY)-11-OXO-, (3.BETA.,4.BETA.)-
Systematic Name English
Code System Code Type Description
FDA UNII
8Y662G4PPI
Created by admin on Sat Dec 16 08:25:15 GMT 2023 , Edited by admin on Sat Dec 16 08:25:15 GMT 2023
PRIMARY
PUBCHEM
44433994
Created by admin on Sat Dec 16 08:25:15 GMT 2023 , Edited by admin on Sat Dec 16 08:25:15 GMT 2023
PRIMARY
CAS
223521-82-2
Created by admin on Sat Dec 16 08:25:15 GMT 2023 , Edited by admin on Sat Dec 16 08:25:15 GMT 2023
PRIMARY