CHEBI:79654 - 3beta-Hydroxy-D-homo-17a-oxa-5alpha-androstan-17-one

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 3beta-Hydroxy-D-homo-17a-oxa-5alpha-androstan-17-one
ChEBI ID CHEBI:79654
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C19H30O3
Net Charge 0
Average Mass 306.43970
Monoisotopic Mass 306.21949
InChI InChI=1S/C19H30O3/c1-18-9-7-13(20)11-12(18)3-4-14-15(18)8-10-19(2)16(14)5-6-17(21)22-19/h12-16,20H,3-11H2,1-2H3/t12-,13-,14+,15-,16-,18-,19-/m0/s1
InChIKey SZKJPNYYJWKGMH-BECBKZTQSA-N
SMILES C[C@]12CC[C@H]3[C@@H](CC[C@H]4C[C@@H](O)CC[C@]34C)[C@@H]1CCC(=O)O2
ChEBI Ontology
Outgoing 3beta-Hydroxy-D-homo-17a-oxa-5alpha-androstan-17-one (CHEBI:79654) is a organic heterotricyclic compound (CHEBI:26979)
3beta-Hydroxy-D-homo-17a-oxa-5alpha-androstan-17-one (CHEBI:79654) is a organooxygen compound (CHEBI:36963)
Synonym Source
Isoandrololactone KEGG COMPOUND
Manual Xref Database
C15136 KEGG COMPOUND
View more database links