CHEBI:62672 - 11α-hydroxyprogesterone 11-glucosiduronic acid

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name 11α-hydroxyprogesterone 11-glucosiduronic acid ChEBI ID CHEBI:62672 ChEBI ASCII Name 11alpha-hydroxyprogesterone 11-glucosiduronic acid Definition A steroid glucosiduronic acid comprising 11alpha-hydroxyprogesterone having a β-Dglucosiduronic acid residue attached to the 11-hydroxy group via a glycosidic linkage. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C27H38O9 Net Charge 0 Average Mass 506.58520 Monoisotopic Mass 506.25158 InChI InChI=1S/C27H38O9/c1-12(28)16-6-7-17-15-5-4-13-10-14(29)8-9-26(13,2)19(15)18(11-27(16,17)3)35-25-22(32)20(30)21(31)23(36-25)24(33)34/h10,15-23,25,30-32H,4-9,11H2,1-3H3,(H,33,34)/t15-,16+,17-,18+,19+,20-,21-,22+,23-,25+,26-,27+/m0/s1 InChIKey WVTMNZAPPOMZST-RKCIHFDFSA-N SMILES [H][C@@]12CCC3=CC(=O)CC[C@]3(C)[C@@]1([H])[C@@H](C[C@]1(C)[C@H](CC[C@@]21[H])C(C)=O)O[C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(O)=O ChEBI Ontology Outgoing 11α-hydroxyprogesterone 11-glucosiduronic acid (CHEBI:62672) has functional parent 11α-hydroxyprogesterone (CHEBI:16076) 11α-hydroxyprogesterone 11-glucosiduronic acid (CHEBI:62672) is a steroid glucosiduronic acid (CHEBI:26763) IUPAC Name 3,20-dioxopregn-4-en-11α-yl β-D-glucopyranosiduronic acid Synonyms Sources 11-Hpg ChemIDplus 11-Hydroxyprogesterone 11-glucuronide ChemIDplus progesterone 11α-glucuronide ChEBI Registry Number Type Source 129238-72-8 CAS Registry Number ChemIDplus Citation Type Source 1908822 PubMed citation Europe PMC Last Modified 02 August 2011