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4a-ethyl-3-methyl-2-pyridin-3-yl-4,9,10,10a-tetrahydro-1H-phenanthrene-2,3,7-triol

4a-ethyl-3-methyl-2-pyridin-3-yl-4,9,10,10a-tetrahydro-1H-phenanthrene-2,3,7-triol

Systemtic Name:4a-ethyl-3-methyl-2-pyridin-3-yl-4,9,10,10a-tetrahydro-1H-phenanthrene-2,3,7-triol
Openeye Name:4a-ethyl-3-methyl-2-(3-pyridyl)-4,9,10,10a-tetrahydro-1H-phenanthrene-2,3,7-triol
CAS Name:4a-ethyl-3-methyl-2-(3-pyridinyl)-4,9,10,10a-tetrahydro-1H-phenanthrene-2,3,7-triol
IUPAC Name:4a-ethyl-3-methyl-2-pyridin-3-yl-4,9,10,10a-tetrahydro-1H-phenanthrene-2,3,7-triol
Traditional Name:4a-ethyl-3-methyl-2-(3-pyridyl)-4,9,10,10a-tetrahydro-1H-phenanthrene-2,3,7-triol
Formula: C22H27NO3
MolecularWeight: 353.45468
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Descriptors Computed from Structure

Canonical SMILES:

CCC12CC(C(CC1CCC3=C2C=CC(=C3)O)(C4=CN=CC=C4)O)(C)O


Isomeric SMILES

CCC12CC(C(CC1CCC3=C2C=CC(=C3)O)(C4=CN=CC=C4)O)(C)O


InChI

InChI=1S/C22H27NO3/c1-3-21-14-20(2,25)22(26,17-5-4-10-23-13-17)12-16(21)7-6-15-11-18(24)8-9-19(15)21/h4-5,8-11,13,16,24-26H,3,6-7,12,14H2,1-2H3


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