Detail of compound @ czechem

Molecular Formula: C₂₇H₄₂O₄

Molecular weight: 430.61998

InChi: InChI=1S/C27H42O4/c1-5-14-31-24(30)9-6-17(2)20-7-8-21-25-22(11-13-27(20,21)4)26(3)12-10-19(28)15-18(26)16-23(25)29/h1,17-23,25,28-29H,6-16H2,2-4H3/t17-,18+,19-,20-,21+,22+,23-,25+,26+,27-/m1/s1

InChi Key: WGVDKDFYZDNAGB-KYNCMJSCSA-N

SMILES: [C@@]12([C@H]([C@H]3[C@H](CC2)[C@@]2([C@H](C[C@H]3O)C[C@@H](CC2)O)C)CC[C@@H]1[C@@H](CCC(=O)OCC#C)C)C

Chemical Name
propargyl 3α,7α-dihydroxy-5β-cholan-24-oate

External Links
PubChem

Authors of compound

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