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ChEBI
> Main
CHEBI:40836 - 5α-androstane-3β,17α-diol
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ChEBI Ontology
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ChEBI Name
5α-androstane-3β,17α-diol
ChEBI ID
CHEBI:40836
ChEBI ASCII Name
5alpha-androstane-3beta,17alpha-diol
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:36694, CHEBI:40832
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Formula
C19H32O2
Net Charge
0
Average Mass
292.45618
Monoisotopic Mass
292.24023
InChI
InChI=1S/C19H32O2/c1-
18-
9-
7-
13(20)
11-
12(18)
3-
4-
14-
15-
5-
6-
17(21)
19(15,2)
10-
8-
16(14)
18/h12-
17,20-
21H,3-
11H2,1-
2H3/t12-
,13-
,14-
,15-
,16-
,17+,18-
,19-
/m0/s1
InChIKey
CBMYJHIOYJEBSB-MFXFBURESA-N
SMILES
[H][C@@]12CC[C@@]3([H])[C@]4([H])CC[C@@H](O)[C@@]4(C)CC[C@]3([H])[C@@]1(C)CC[C@H](O)C2
ChEBI Ontology
Outgoing
5α-androstane-3β,17α-diol (
CHEBI:40836
)
is a
17α-hydroxy steroid (
CHEBI:35342
)
5α-androstane-3β,17α-diol (
CHEBI:40836
)
is a
3β-hydroxy steroid (
CHEBI:36836
)
5α-androstane-3β,17α-diol (
CHEBI:40836
)
is a
androstane-3,17-diol (
CHEBI:27727
)
Incoming
5α-androstane-3β,17α-diol disulfate (
CHEBI:133112
)
has functional parent
5α-androstane-3β,17α-diol (
CHEBI:40836
)
IUPAC Name
5α-androstane-3β,17α-diol
Synonym
Source
5-ALPHA-ANDROSTANE-3-BETA,17-ALPHA-DIOL
PDBeChem
Manual Xrefs
Databases
AON
PDBeChem
DB03926
DrugBank
View more database links
Registry Number
Type
Source
2559487
Beilstein Registry Number
Beilstein
Last Modified
22 August 2016