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6beta-hydroxyestradiol-17beta

Properties

Image

Occurences in reactions

MNX_ID

MNXM3881

	#reac
in my sandbox	0
in MNXref (generic)	5
in models (compartimentalized)	1

formula

C₁₈H₂₄O₃

charge

mass

288.17254

reference

chebi:16784

InChIKey

QZZRQURPSRWTLG-UXCAXZQLSA-N

InChI

InChI=1S/C18H24O3/c1-18-7-6-12-11-3-2-10(19)8-14(11)16(20)9-13(12)15(18)4-5-17(18)21/h2-3,8,12-13,15-17,19-21H,4-7,9H2,1H3/t12-,13-,15+,16-,17+,18+/m1/s1

SMILES

C[C@]12CC[C@@H]3c4ccc(O)cc4[C@H](O)C[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
CHEBI:16784 chebi:16784	6beta-hydroxyestradiol-17beta 6beta-Hydroxyestradiol-17beta 6beta-hydroxy-17beta-estradiol estra-1,3,5(10)-triene-3,6beta,17beta-triol
kegg.compound:C03935 keggC:C03935	6beta-Hydroxy-17beta-estradiol 6beta-Hydroxyestradiol-17beta
metacyc.compound:CPD-1077 metacycM:CPD-1077	6beta-Hydroxyestradiol-17beta
seed.compound:cpd02447 seedM:cpd02447	6beta-Hydroxyestradiol-17beta 6beta-Hydroxy-17beta-estradiol
lipidmaps:LMST02010031 lipidmapsM:LMST02010031	6beta-Hydroxyestradiol-17beta O3 ST 18:3 estra-1,3,5(10)-triene-3,6beta,17beta-triol
SLM:000485706 slm:000485706	6beta-hydroxyestradiol-17beta
chebi:12238 chebi:20762 chebi:2242 keggC:M_C03935 seedM:M_cpd02447	secondary/obsolete/fantasy identifier