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5beta-pregnan-3,20-dione

MNXM729570 is deprecated and replaced by MNXM729569

Properties

Image

Occurences in reactions

MNX_ID

MNXM729569

	#reac
in my sandbox	0
in MNXref (generic)	9
in models (compartimentalized)	3

formula

C₂₁H₃₂O₂

charge

mass

316.24023

reference

InChIKey

XMRPGKVKISIQBV-XWOJZHJZSA-N

InChI

InChI=1S/C21H32O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h14,16-19H,4-12H2,1-3H3/t14-,16+,17-,18+,19+,20+,21-/m1/s1

SMILES

CC(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:30154 chebi:30154	5beta-pregnan-3,20-dione (5BETA)-PREGNANE-3,20-DIONE 3,20-pregnanedione 5beta-Pregnane-3,20-dione 5beta-dihydroprogesterone 5beta-pregnane-3,20-dione
sabiork.compound:7949 sabiorkM:7949 kegg.compound:C05479 keggC:C05479	5beta-Pregnane-3,20-dione
seed.compound:cpd03260 seedM:cpd03260	5beta-Pregnane-3,20-dione 5-beta-pregnan-3,20 dione
metacyc.compound:CPD-5962 metacycM:CPD-5962	5beta-pregnan-3,20 dione
SLM:000390130 slm:000390130	5beta-pregnan-3,20-dione
lipidmaps:LMST02030146 lipidmapsM:LMST02030146	5beta-pregnane-3,20-dione (5BETA)-PREGNANE-3,20-DIONE 3,20-pregnanedione 5beta-Pregnane-3,20-dione 5beta-dihydroprogesterone 5beta-pregnan-3,20-dione 5beta-pregnane-3,20-dione O2 ST 21:2
chebi:12180 chebi:2151 chebi:41572 keggC:M_C05479 seedM:M_cpd03260	secondary/obsolete/fantasy identifier