Services
Research
Training
Industry
About us
ChEBI
Examples:
iron*
,
InChI=1S/CH4O/c1-2/h2H,1H3
,
caffeine
Advanced
Home
Advanced Search
Browse
Documentation
Download
Tools
About ChEBI
Submit
Contact us
DiNA
Statistics
Entity of the Month
Periodic Table
Ontology
Train online
User Manual
Annotation Manual
Developer Manual
FAQ's
BiNChE
libChEBI
Web Services
ChEBI
> Main
CHEBI:15938 - pregnan-21-ol
Main
ChEBI Ontology
Automatic Xrefs
Reactions
Pathways
Models
ChEBI Name
pregnan-21-ol
ChEBI ID
CHEBI:15938
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:8385, CHEBI:14880, CHEBI:26231
Supplier Information
Download
Molfile
XML
SDF
Find compounds which contain this structure
Find compounds which resemble this structure
Take structure to the Advanced Search
Formula
C21H36O
Net Charge
0
Average Mass
304.50994
Monoisotopic Mass
304.27662
InChI
InChI=1S/C21H36O/c1-
20-
12-
4-
3-
5-
15(20)
6-
8-
17-
18-
9-
7-
16(11-
14-
22)
21(18,2)
13-
10-
19(17)
20/h15-
19,22H,3-
14H2,1-
2H3/t15?,16-
,17+,18+,19+,20+,21-
/m1/s1
InChIKey
DBMUNIJZUYVPCQ-XFNFOBRPSA-N
SMILES
[H][C@@]12CCC3CCCC[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@@H](CCO)CC[C@@]21[H]
ChEBI Ontology
Outgoing
pregnan-21-ol (
CHEBI:15938
)
has parent hydride
pregnane (
CHEBI:8386
)
pregnan-21-ol (
CHEBI:15938
)
is a
21-hydroxy steroid (
CHEBI:35344
)
pregnan-21-ol (
CHEBI:15938
)
is a
C
21
-steroid (
CHEBI:61313
)
IUPAC Name
pregnan-21-ol
Synonyms
Sources
5-beta-Pregnan-21-ol
KEGG COMPOUND
Pregnan-21-ol
KEGG COMPOUND
pregnan-21-ol
UniProt
Manual Xref
Database
C00892
KEGG COMPOUND
View more database links
Last Modified
13 November 2017