4b-ethyl-6,7-bis(oxidanyl)-7-prop-1-ynyl-5,6,8,8a,9,10-hexahydrophenanthrene-2-carboxylic acid

Systemtic Name: 4b-ethyl-6,7-bis(oxidanyl)-7-prop-1-ynyl-5,6,8,8a,9,10-hexahydrophenanthrene-2-carboxylic acid Openeye Name: 4b-ethyl-6,7-dihydroxy-7-prop-1-ynyl-5,6,8,8a,9,10-hexahydrophenanthrene-2-carboxylic acid CAS Name: 4b-ethyl-6,7-dihydroxy-7-prop-1-ynyl-5,6,8,8a,9,10-hexahydrophenanthrene-2-carboxylic acid IUPAC Name: 4b-ethyl-6,7-dihydroxy-7-prop-1-ynyl-5,6,8,8a,9,10-hexahydrophenanthrene-2-carboxylic acid Traditional Name: 4b-ethyl-6,7-dihydroxy-7-prop-1-ynyl-5,6,8,8a,9,10-hexahydrophenanthrene-2-carboxylic acid Formula: C20H24O4 MolecularWeight: 328.40216

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Descriptors Computed from Structure

Canonical SMILES:

CCC12CC(C(CC1CCC3=C2C=CC(=C3)C(=O)O)(C#CC)O)O

Isomeric SMILES

CCC12CC(C(CC1CCC3=C2C=CC(=C3)C(=O)O)(C#CC)O)O

InChI

InChI=1S/C20H24O4/c1-3-9-20(24)11-15-7-5-13-10-14(18(22)23)6-8-16(13)19(15,4-2)12-17(20)21/h6,8,10,15,17,21,24H,4-5,7,11-12H2,1-2H3,(H,22,23)