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Urocortisone

Properties

Image

Occurences in reactions

MNX_ID

MNXM735695

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

formula

C₂₁H₃₂O₅

charge

mass

364.22497

reference

chebi:9901

InChIKey

SYGWGHVTLUBCEM-ZIZPXRJBSA-N

InChI

InChI=1S/C21H32O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h12-15,18,22-23,26H,3-11H2,1-2H3/t12-,13-,14+,15+,18-,19+,20+,21+/m1/s1

SMILES

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

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:9901 chebi:9901	Urocortisone (1S,2S,5S,7S,10S,11S,14R,15S)-5,14-dihydroxy-14-(2-hydroxyacetyl)-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecan-17-one (3a,5b)-3,17,21-trihydroxy-pregnane-11,20-dione 3,17-Dihydroxy-17-hydroxyacetyl-10,13-dimethyl-hexadecahydro-cyclopenta[a]phenanthren-11-one 3a,17,21-Trihydroxy-5a-pregnane-11,20-dione 3a,17,21-Trihydroxy-5b-pregnane-11,20-dione 3alpha,17,21-Trihydroxypregnane-11,20-dione 3alpha,17,21-trihydroxy-5beta-Pregnane-11,20-dione 3b,17,21-Trihydroxy-5a-pregnane-11,20-dione 5a-Pregnan-3b,17a,21-triol-11,20-dion Ba 2681 Tetrahydro E Tetrahydro-Cortisone Tetrahydrocompound E Tetrahydrocortison
sabiork.compound:26651 sabiorkM:26651	Tetrahydrocortisone 5beta-Pregnane-3alpha,17alpha,21-triol-11,20-dione Urocortisone
kegg.compound:C05470 keggC:C05470	Tetrahydrocortisone Urocortisone
lipidmaps:LMST02030098 lipidmapsM:LMST02030098	Urocortisone 3alpha,17alpha,21-dihydroxy-5beta-pregnane-11,20-dione O5 ST 21:2 Tetrahydrocortisone
seed.compound:cpd03251 seedM:cpd03251	Urocortisone Tetrahydrocortisone urocortisone
keggC:M_C05470 seedM:M_cpd03251	secondary/obsolete/fantasy identifier