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4a-ethyl-3-methyl-2-(1,3-thiazol-2-yl)-4,9,10,10a-tetrahydro-1H-phenanthrene-2,3,7-triol
4a-ethyl-3-methyl-2-(1,3-thiazol-2-yl)-4,9,10,10a-tetrahydro-1H-phenanthrene-2,3,7-triol
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Descriptors Computed from Structure
Canonical SMILES:
CCC12CC(C(CC1CCC3=C2C=CC(=C3)O)(C4=NC=CS4)O)(C)O
Isomeric SMILES
CCC12CC(C(CC1CCC3=C2C=CC(=C3)O)(C4=NC=CS4)O)(C)O
InChI
InChI=1S/C20H25NO3S/c1-3-19-12-18(2,23)20(24,17-21-8-9-25-17)11-14(19)5-4-13-10-15(22)6-7-16(13)19/h6-10,14,22-24H,3-5,11-12H2,1-2H3
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