CHEBI:79636 - 3-Methyl-19-nor-17alpha-pregna-1,3,5(10)-trien-17-ol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 3-Methyl-19-nor-17alpha-pregna-1,3,5(10)-trien-17-ol
ChEBI ID CHEBI:79636
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C21H30O
Net Charge 0
Average Mass 298.46230
Monoisotopic Mass 298.22967
InChI InChI=1S/C21H30O/c1-4-21(22)12-10-19-18-8-6-15-13-14(2)5-7-16(15)17(18)9-11-20(19,21)3/h5,7,13,17-19,22H,4,6,8-12H2,1-3H3/t17-,18-,19+,20+,21+/m1/s1
InChIKey VOJSXGZKQUZFCX-MJCUULBUSA-N
SMILES CC[C@]1(O)CC[C@H]2[C@@H]3CCc4cc(C)ccc4[C@H]3CC[C@]12C
ChEBI Ontology
Outgoing 3-Methyl-19-nor-17alpha-pregna-1,3,5(10)-trien-17-ol (CHEBI:79636) has parent hydride pregnane (CHEBI:8386)
3-Methyl-19-nor-17alpha-pregna-1,3,5(10)-trien-17-ol (CHEBI:79636) is a steroid (CHEBI:35341)
Manual Xref Database
C15117 KEGG COMPOUND
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