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3-Methoxy-5,10-seco-5,19-cycloandrosta-1(10),2,4-trien-17-one

Properties

Image

Occurences in reactions

MNX_ID

MNXM36594

	#reac
in my sandbox	0
in MNXref (generic)	0
in models (compartimentalized)	0

formula

C₂₀H₂₆O₂

charge

mass

298.19328

reference

InChIKey

FBRCEPPRCFBOKU-XSYGEPLQSA-N

InChI

InChI=1S/C20H26O2/c1-20-10-9-16-14-4-5-15(22-2)12-13(11-14)3-6-17(16)18(20)7-8-19(20)21/h4-5,12,16-18H,3,6-11H2,1-2H3/t16-,17-,18+,20+/m1/s1

SMILES

COC1=CC=C2CC(=C1)CC[C@@H]1[C@@H]2CC[C@]2(C)C(=O)CC[C@@H]12

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
seed.compound:cpd10808 seedM:cpd10808 CHEBI:79633 chebi:79633 kegg.compound:C15114 keggC:C15114	3-Methoxy-5,10-seco-5,19-cycloandrosta-1(10),2,4-trien-17-one 3-Methoxy-5,19-cyclo-5,10-secoandrosta-1(10),2,4-trien-17-one
keggC:M_C15114 seedM:M_cpd10808	secondary/obsolete/fantasy identifier