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> Main
CHEBI:79540 - 17beta-Hydroxy-5alpha-androst-2-ene-2-carboxaldehyde
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ChEBI Name
17beta-Hydroxy-5alpha-androst-2-ene-2-carboxaldehyde
ChEBI ID
CHEBI:79540
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This entity has been manually annotated by a third party.
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Formula
C20H30O2
Net Charge
0
Average Mass
302.45100
Monoisotopic Mass
302.22458
InChI
InChI=1S/C20H30O2/c1-
19-
10-
9-
17-
15(16(19)
7-
8-
18(19)
22)
6-
5-
14-
4-
3-
13(12-
21)
11-
20(14,17)
2/h3,12,14-
18,22H,4-
11H2,1-
2H3/t14-
,15+,16+,17+,18+,19+,20+/m1/s1
InChIKey
QKKCZNAIRYQRKP-WDCLZLQXSA-N
SMILES
C[C@]12CC[C@H]3[C@@H](CC[C@H]4CC=C(C[C@]34C)C=O)[C@@H]1CC[C@@H]2O
ChEBI Ontology
Outgoing
17beta-Hydroxy-5alpha-androst-2-ene-2-carboxaldehyde (
CHEBI:79540
)
is a
androstanoid (
CHEBI:50402
)
17beta-Hydroxy-5alpha-androst-2-ene-2-carboxaldehyde (
CHEBI:79540
)
is a
steroid aldehyde (
CHEBI:131565
)
Manual Xref
Database
C15017
KEGG COMPOUND
View more database links
Registry Number
Type
Source
601-16-1
CAS Registry Number
KEGG COMPOUND
Last Modified
17 March 2016