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4-hydroxy-17beta-estradiol

MNXM729395 is deprecated and replaced by MNXM729393

Properties

Image

Occurences in reactions

MNX_ID

MNXM729393

	#reac
in my sandbox	0
in MNXref (generic)	8
in models (compartimentalized)	16

formula

C₁₈H₂₄O₃

charge

mass

288.17254

reference

chebi:62845

InChIKey

QOZFCKXEVSGWGS-ZHIYBZGJSA-N

InChI

InChI=1S/C18H24O3/c1-18-9-8-11-10-4-6-15(19)17(21)13(10)3-2-12(11)14(18)5-7-16(18)20/h4,6,11-12,14,16,19-21H,2-3,5,7-9H2,1H3/t11-,12-,14+,16+,18+/m1/s1

SMILES

C[C@]12CC[C@@H]3c4ccc(O)c(O)c4CC[C@H]3[C@@H]1CC[C@@H]2O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
reactome:R-ALL-211973 reactomeM:R-ALL-211973 CHEBI:62845 chebi:62845	4-hydroxy-17beta-estradiol 3,4,17beta-estriol 3,4,17beta-trihydroxy-1,3,5[10]-estratriene 4-Hydroxyestradiol-17beta 4-OH-Estradiol 4-hydroxyestradiol 4OHE2 estra-1,3,5(10)-triene-3,14,17beta-triol
bigg.metabolite:hestratriol biggM:hestratriol	4,17 dihydroxy estradiol
sabiork.compound:21039 sabiorkM:21039	4-Hydroxyestradiol
sabiork.compound:21470 sabiorkM:21470 kegg.compound:C14209 keggC:C14209	4-Hydroxyestradiol-17beta 4-OH-Estradiol
seed.compound:cpd09908 seedM:cpd09908	4-OH-Estradiol 4-Hydroxyestradiol-17beta
SLM:000485708 slm:000485708	4-hydroxy-17beta-estradiol
lipidmaps:LMST02010028 lipidmapsM:LMST02010028	4-hydroxyestradiol O3 ST 18:3 estra-1,3,5(10)-triene-2,4,17beta-triol
envipath:...71135e895af3 envipathM:...71135e895af3	compound 0044846
chebi:34424 biggM:M_hestratriol keggC:M_C14209 seedM:M_cpd09908	secondary/obsolete/fantasy identifier