allopregnan-3beta-ol-20-one
group of isomeric compounds
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allopregnan-3beta-ol-20-one
Summary
allopregnan-3beta-ol-20-one is a group of isomeric entities[1].
Key Facts
- allopregnan-3beta-ol-20-one's instance of is recorded as group of isomeric entities[2].
- allopregnan-3beta-ol-20-one's canonical SMILES is recorded as CC(=O)C1CCC2C1(CCC3C2CCC4C3(CCC(C4)O)C)C[3].
- allopregnan-3beta-ol-20-one's InChI is recorded as InChI=1S/C21H34O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h14-19,23H,4-12H2,1-3H3[4].
- allopregnan-3beta-ol-20-one's InChIKey is recorded as AURFZBICLPNKBZ-UHFFFAOYSA-N[5].
- allopregnan-3beta-ol-20-one's chemical formula is recorded as C₂₁H₃₄O₂[6].
- allopregnan-3beta-ol-20-one's subclass of is recorded as pregnane steroid[7].
- allopregnan-3beta-ol-20-one's PubChem CID is recorded as 262961[8].
- allopregnan-3beta-ol-20-one's Human Metabolome Database ID is recorded as HMDB0245902[9].
- allopregnan-3beta-ol-20-one's mass is recorded as {'unit': 'http://www.wikidata.org/entity/Q483261', 'amount': '+318.4942'}[10].
- allopregnan-3beta-ol-20-one's SureChEMBL ID is recorded as 6447469[11].
- allopregnan-3beta-ol-20-one's NMRShiftDB structure ID is recorded as 10009052[12].
- allopregnan-3beta-ol-20-one's UniChem compound ID is recorded as 884516[13].
- allopregnan-3beta-ol-20-one's Probes And Drugs ID is recorded as PD040426[14].