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

Details

Stereochemistry ABSOLUTE
Molecular Formula C27H44O8
Molecular Weight 496.6345
Optical Activity UNSPECIFIED
Defined Stereocenters 11 / 11
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TURKESTERONE

SMILES

CC(C)(CC[C@]([H])([C@@](C)([C@@]1([H])CC[C@]2(C3=CC(=O)[C@]4([H])C[C@]([H])([C@]([H])(C[C@]4(C)[C@@]3([H])[C@@]([H])(C[C@]12C)O)O)O)O)O)O)O

InChI

InChIKey=WSBAGDDNVWTLOM-XHZKDPLLSA-N
InChI=1S/C27H44O8/c1-23(2,33)8-7-21(32)26(5,34)20-6-9-27(35)15-11-16(28)14-10-17(29)18(30)12-24(14,3)22(15)19(31)13-25(20,27)4/h11,14,17-22,29-35H,6-10,12-13H2,1-5H3/t14-,17+,18-,19+,20-,21+,22+,24-,25+,26+,27+/m0/s1

HIDE SMILES / InChI

Molecular Formula C27H44O8
Molecular Weight 496.6345
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 11 / 11
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Patents
Substance Class Chemical
Created
by admin
on Sat Jun 26 00:37:50 UTC 2021
Edited
by admin
on Sat Jun 26 00:37:50 UTC 2021
Record UNII
53E6Z3F8ZG
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TURKESTERONE
Common Name English
CHOLEST-7-EN-6-ONE, 2,3,11,14,20,22,25-HEPTAHYDROXY-, (2.BETA.,3.BETA.,5.BETA.,11.ALPHA.,22R)-
Common Name English
(2.BETA.,3.BETA.,5.BETA.,11.ALPHA.,22R)-2,3,11,14,20,22,25-HEPTAHYDROXYCHOLEST-7-EN-6-ONE
Common Name English
Code System Code Type Description
CAS
41451-87-0
Created by admin on Sat Jun 26 00:37:50 UTC 2021 , Edited by admin on Sat Jun 26 00:37:50 UTC 2021
PRIMARY
PUBCHEM
14376672
Created by admin on Sat Jun 26 00:37:50 UTC 2021 , Edited by admin on Sat Jun 26 00:37:50 UTC 2021
PRIMARY
MESH
C017787
Created by admin on Sat Jun 26 00:37:50 UTC 2021 , Edited by admin on Sat Jun 26 00:37:50 UTC 2021
PRIMARY
FDA UNII
53E6Z3F8ZG
Created by admin on Sat Jun 26 00:37:50 UTC 2021 , Edited by admin on Sat Jun 26 00:37:50 UTC 2021
PRIMARY