CHEBI:143312 - (1S,7R,9bR)-9b-fluoro-1,9a,11a-trimethyl-2H,3H,3aH,3bH,4H,5H,7H,8H,9H,10H,11H-cyclopenta[a]phenanthrene-1,5,7,10-tetrol

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ChEBI Name (1S,7R,9bR)-9b-fluoro-1,9a,11a-trimethyl-2H,3H,3aH,3bH,4H,5H,7H,8H,9H,10H,11H-cyclopenta[a]phenanthrene-1,5,7,10-tetrol
ChEBI ID CHEBI:143312
Stars This entity has been manually annotated by a third party.
Submitter Mark Williams
Supplier Information
Download Molfile XML SDF
Formula C20H31FO4
Net Charge 0
Average Mass 354.457
Monoisotopic Mass 354.221
InChI InChI=1S/C20H31FO4/c1-17-6-4-11(22)8-14(17)15(23)9-13-12-5-7-19(3,25)18(12,2)10-16(24)20(13,17)21/h8,11-13,15-16,22-25H,4-7,9-10H2,1-3H3/t11-,12?,13?,15?,16?,17?,18?,19+,20+/m1/s1
InChIKey FOLOIUYKGZEVJY-FUBJFMCOSA-N
SMILES F[C@@]12C3(C(=C[C@H](O)CC3)C(O)CC1C4CC[C@@](C4(CC2O)C)(O)C)C
Roles Classification
Biological Role(s): androgen
A sex hormone that stimulates or controls the development and maintenance of masculine characteristics in vertebrates by binding to androgen receptors.
(via (1S,7R,9bR)-9b-fluoro-1,9a,11a-trimethyl-2H,3H,3aH,3bH,4H,5H,7H,8H,9H,10H,11H-cyclopenta[a]phenanthrene-1,5,7,10-tetrol )
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ChEBI Ontology
Outgoing (1S,7R,9bR)-9b-fluoro-1,9a,11a-trimethyl-2H,3H,3aH,3bH,4H,5H,7H,8H,9H,10H,11H-cyclopenta[a]phenanthrene-1,5,7,10-tetrol (CHEBI:143312) has role androgen (CHEBI:50113)
(1S,7R,9bR)-9b-fluoro-1,9a,11a-trimethyl-2H,3H,3aH,3bH,4H,5H,7H,8H,9H,10H,11H-cyclopenta[a]phenanthrene-1,5,7,10-tetrol (CHEBI:143312) is a 3-hydroxy steroid (CHEBI:36834)