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

Details

Stereochemistry ABSOLUTE
Molecular Formula C28H46O
Molecular Weight 398.6642
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 22,23-DIHYDROERGOSTEROL

SMILES

[H][C@@]1(CC[C@@]2([H])C3=CC=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CC[C@H](C)C(C)C

InChI

InChIKey=ZKQRGSXITBHHPC-VVQHAZRASA-N
InChI=1S/C28H46O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h9-10,18-20,22,24-26,29H,7-8,11-17H2,1-6H3/t19-,20+,22-,24+,25-,26-,27-,28+/m0/s1

HIDE SMILES / InChI

Molecular Formula C28H46O
Molecular Weight 398.6642
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 8 / 8
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:38:20 GMT 2023
Edited
by admin
on Sat Dec 16 08:38:20 GMT 2023
Record UNII
AZW48AYG7C
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
22,23-DIHYDROERGOSTEROL
Common Name English
PROVITAMIN D4
Common Name English
22,23-DIHYDROERGOSTEROL, NON-IRRADIATED
Common Name English
DIHYDROERGOSTEROL
Common Name English
24S-METHYLCHOLESTA-5,7-DIEN-3.BETA.-OL
Systematic Name English
5,7-ERGOSTADIENOL
Systematic Name English
(3S,9S,10R,13R,14R,17R)-17-((2R,5S)-5,6-DIMETHYLHEPTAN-2-YL)-10,13-DIMETHYL-2,3,4,9,11,12,14,15,16,17-DECAHYDRO-1H-CYCLOPENTA(A)PHENANTHREN-3-OL
Systematic Name English
(3.BETA.)-ERGOSTA-5,7-DIEN-3-OL
Systematic Name English
ERGOSTA-5,7-DIEN-3.BETA.-OL
Systematic Name English
ERGOSTA-5,7-DIEN-3-OL, (3.BETA.)-
Systematic Name English
.DELTA.5,7-ERGOSTADIENOL
Common Name English
Code System Code Type Description
CAS
516-79-0
Created by admin on Sat Dec 16 08:38:20 GMT 2023 , Edited by admin on Sat Dec 16 08:38:20 GMT 2023
PRIMARY
PUBCHEM
5326970
Created by admin on Sat Dec 16 08:38:20 GMT 2023 , Edited by admin on Sat Dec 16 08:38:20 GMT 2023
PRIMARY
FDA UNII
AZW48AYG7C
Created by admin on Sat Dec 16 08:38:20 GMT 2023 , Edited by admin on Sat Dec 16 08:38:20 GMT 2023
PRIMARY
CHEBI
66918
Created by admin on Sat Dec 16 08:38:20 GMT 2023 , Edited by admin on Sat Dec 16 08:38:20 GMT 2023
PRIMARY
EPA CompTox
DTXSID60965924
Created by admin on Sat Dec 16 08:38:20 GMT 2023 , Edited by admin on Sat Dec 16 08:38:20 GMT 2023
PRIMARY
ECHA (EC/EINECS)
208-226-3
Created by admin on Sat Dec 16 08:38:20 GMT 2023 , Edited by admin on Sat Dec 16 08:38:20 GMT 2023
PRIMARY