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

Details

Stereochemistry ABSOLUTE
Molecular Formula C27H42O8
Molecular Weight 494.6176
Optical Activity UNSPECIFIED
Defined Stereocenters 10 / 10
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of .ALPHA.-CORTOL 3,20,21-TRIACETATE

SMILES

[H][C@@]12CC[C@](O)([C@H](COC(C)=O)OC(C)=O)[C@@]1(C)C[C@H](O)[C@@]3([H])[C@@]2([H])CC[C@]4([H])C[C@@H](CC[C@]34C)OC(C)=O

InChI

InChIKey=FICWUNWLQRZWFP-XJRUUCHDSA-N
InChI=1S/C27H42O8/c1-15(28)33-14-23(35-17(3)30)27(32)11-9-21-20-7-6-18-12-19(34-16(2)29)8-10-25(18,4)24(20)22(31)13-26(21,27)5/h18-24,31-32H,6-14H2,1-5H3/t18-,19-,20+,21+,22+,23+,24-,25+,26+,27+/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
.ALPHA.-CORTOL 3,20,21-TRIACETATE
MI  
Common Name English
.ALPHA.-CORTOL 3,20,21-TRIACETATE [MI]
Common Name English
Code System Code Type Description
FDA UNII
62235Y0Z1G
Created by admin on Sat Dec 16 09:16:43 GMT 2023 , Edited by admin on Sat Dec 16 09:16:43 GMT 2023
PRIMARY
CAS
5914-97-6
Created by admin on Sat Dec 16 09:16:43 GMT 2023 , Edited by admin on Sat Dec 16 09:16:43 GMT 2023
PRIMARY
PUBCHEM
73425420
Created by admin on Sat Dec 16 09:16:43 GMT 2023 , Edited by admin on Sat Dec 16 09:16:43 GMT 2023
PRIMARY