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

Details

Stereochemistry ABSOLUTE
Molecular Formula C27H48
Molecular Weight 372.67
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of COPROSTANE

SMILES

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

InChI

InChIKey=XIIAYQZJNBULGD-CJPSHIORSA-N
InChI=1S/C27H48/c1-19(2)9-8-10-20(3)23-14-15-24-22-13-12-21-11-6-7-17-26(21,4)25(22)16-18-27(23,24)5/h19-25H,6-18H2,1-5H3/t20-,21+,22+,23-,24+,25+,26+,27-/m1/s1

HIDE SMILES / InChI

Molecular Formula C27H48
Molecular Weight 372.67
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 8 / 8
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

PubMed

PubMed

TitleDatePubMed
Urinary bile alcohol profiles in healthy and cholestatic children.
2001 Dec
Substance Class Chemical
Created
by admin
on Sat Dec 16 08:51:53 GMT 2023
Edited
by admin
on Sat Dec 16 08:51:53 GMT 2023
Record UNII
6P255N992E
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
COPROSTANE
MI  
Common Name English
COPROSTANE [MI]
Common Name English
CHOLESTANE, (5.BETA.)-
Systematic Name English
5.BETA.-CHOLESTANE
Systematic Name English
.BETA.-CHOLESTANE
Common Name English
PSEUDOCHOLESTANE
Common Name English
Code System Code Type Description
FDA UNII
6P255N992E
Created by admin on Sat Dec 16 08:51:53 GMT 2023 , Edited by admin on Sat Dec 16 08:51:53 GMT 2023
PRIMARY
CAS
481-20-9
Created by admin on Sat Dec 16 08:51:53 GMT 2023 , Edited by admin on Sat Dec 16 08:51:53 GMT 2023
PRIMARY
WIKIPEDIA
Coprostane
Created by admin on Sat Dec 16 08:51:53 GMT 2023 , Edited by admin on Sat Dec 16 08:51:53 GMT 2023
PRIMARY
PUBCHEM
5283630
Created by admin on Sat Dec 16 08:51:53 GMT 2023 , Edited by admin on Sat Dec 16 08:51:53 GMT 2023
PRIMARY
CHEBI
35517
Created by admin on Sat Dec 16 08:51:53 GMT 2023 , Edited by admin on Sat Dec 16 08:51:53 GMT 2023
PRIMARY
EPA CompTox
DTXSID501025616
Created by admin on Sat Dec 16 08:51:53 GMT 2023 , Edited by admin on Sat Dec 16 08:51:53 GMT 2023
PRIMARY
MERCK INDEX
m3778
Created by admin on Sat Dec 16 08:51:53 GMT 2023 , Edited by admin on Sat Dec 16 08:51:53 GMT 2023
PRIMARY Merck Index