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Details

Stereochemistry ABSOLUTE
Molecular Formula C27H48O4
Molecular Weight 436.6676
Optical Activity UNSPECIFIED
Defined Stereocenters 12 / 12
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Cholestane-3?,7?,12?,23?-tetrol, 5?-

SMILES

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

InChI

InChIKey=VGCSSPQIZFVVCH-MYKQRDHBSA-N
InChI=1S/C27H48O4/c1-15(2)10-19(29)11-16(3)20-6-7-21-25-22(14-24(31)27(20,21)5)26(4)9-8-18(28)12-17(26)13-23(25)30/h15-25,28-31H,6-14H2,1-5H3/t16-,17+,18-,19-,20-,21+,22+,23-,24+,25+,26+,27-/m1/s1

HIDE SMILES / InChI

Molecular Formula C27H48O4
Molecular Weight 436.6676
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 12 / 12
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 05:49:22 GMT 2025
Edited
by admin
on Wed Apr 02 05:49:22 GMT 2025
Record UNII
DH57XE4PT3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(23R)-5?-Cholestane-3?,7?,12?,23-tetrol
Preferred Name English
Cholestane-3?,7?,12?,23?-tetrol, 5?-
Common Name English
5?-Cholestane-3?,7?,12?,23?-tetrol
Common Name English
(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-17-[(2R,4R)-4-hydroxy-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7,12-triol
Systematic Name English
(3?,5?,7?,12?,23R)-Cholestane-3,7,12,23-tetrol
Common Name English
Cholestane-3,7,12,23-tetrol, (3?,5?,7?,12?,23R)-
Common Name English
Code System Code Type Description
PUBCHEM
194289
Created by admin on Wed Apr 02 05:49:22 GMT 2025 , Edited by admin on Wed Apr 02 05:49:22 GMT 2025
PRIMARY
EPA CompTox
DTXSID60988537
Created by admin on Wed Apr 02 05:49:22 GMT 2025 , Edited by admin on Wed Apr 02 05:49:22 GMT 2025
PRIMARY
CAS
68832-44-0
Created by admin on Wed Apr 02 05:49:22 GMT 2025 , Edited by admin on Wed Apr 02 05:49:22 GMT 2025
PRIMARY
FDA UNII
DH57XE4PT3
Created by admin on Wed Apr 02 05:49:22 GMT 2025 , Edited by admin on Wed Apr 02 05:49:22 GMT 2025
PRIMARY