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Amb33850731

Duplicate ID
Molecule Name Methyl 3-hydroxyandrostane-17-carboxylate
SmilesC[C@]12CC[C@H]3[C@@H](CC[C@@H]4C[C@@H](O)CC[C@@]43C)[C@@H]1CC[C@@H]2C(=O)OC
InchiKeyNTIDOCUQWIFRTK-PFIRBALFSA-N
InChi InChI=1S/C21H34O3/c1-20-10-8-14(22)12-13(20)4-5-15-16-6-7-18(19(23)24-3)21(16,2)11-9-17(15)20/h13-18,22H,4-12H2,1-3H3/t13-,14+,15+,16+,17+,18-,20+,21+/m1/s1
Formula C21H34O3
Molecular weight 334.493
Rings 4
logP 4.1792
PSA 46.53
MR 96.5318
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