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

Details

Stereochemistry ABSOLUTE
Molecular Formula C30H46O8
Molecular Weight 534.6814
Optical Activity UNSPECIFIED
Defined Stereocenters 13 / 13
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DESACETYLOLEANDRIN

SMILES

[H][C@@]1(C[C@H](OC)[C@@H](O)[C@H](C)O1)O[C@H]2CC[C@@]3(C)[C@]([H])(CC[C@]4([H])[C@]3([H])CC[C@]5(C)[C@H]([C@@H](O)C[C@]45O)C6=CC(=O)OC6)C2

InChI

InChIKey=ROKXRURUBUVHBD-QSHOECCGSA-N
InChI=1S/C30H46O8/c1-16-27(33)23(35-4)13-25(37-16)38-19-7-9-28(2)18(12-19)5-6-21-20(28)8-10-29(3)26(17-11-24(32)36-15-17)22(31)14-30(21,29)34/h11,16,18-23,25-27,31,33-34H,5-10,12-15H2,1-4H3/t16-,18+,19-,20-,21+,22-,23-,25-,26-,27-,28-,29+,30-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
DESACETYLOLEANDRIN
MI  
Common Name English
CARD-20(22)-ENOLIDE, 3-((2,6-DIDEOXY-3-O-METHYL-L-ARABINO-HEXOPYRANOSYL)OXY)-14,16-DIHYDROXY-, (3.BETA.,5.BETA.,16.BETA.)-
Systematic Name English
DESACETYLOLEANDRIN [MI]
Common Name English
16-DESACETYLOLEANDRIN
Common Name English
16-DEACETYLOLEANDRIN
Common Name English
DEACETYLOLEANDRIN
Common Name English
Code System Code Type Description
CAS
36190-93-9
Created by admin on Sat Dec 16 10:02:40 GMT 2023 , Edited by admin on Sat Dec 16 10:02:40 GMT 2023
PRIMARY
FDA UNII
EBI62AI90G
Created by admin on Sat Dec 16 10:02:40 GMT 2023 , Edited by admin on Sat Dec 16 10:02:40 GMT 2023
PRIMARY
MERCK INDEX
m8189
Created by admin on Sat Dec 16 10:02:40 GMT 2023 , Edited by admin on Sat Dec 16 10:02:40 GMT 2023
PRIMARY Merck Index
PUBCHEM
76962086
Created by admin on Sat Dec 16 10:02:40 GMT 2023 , Edited by admin on Sat Dec 16 10:02:40 GMT 2023
PRIMARY
EPA CompTox
DTXSID501316360
Created by admin on Sat Dec 16 10:02:40 GMT 2023 , Edited by admin on Sat Dec 16 10:02:40 GMT 2023
PRIMARY