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17-[(3-ethyl-3-oxidanyl-pentoxy)methyl]-10,13-dimethyl-2,3,4,9,11,12,14,15-octahydro-1H-cyclopenta[a]phenanthrene-1,3-diol

17-[(3-ethyl-3-oxidanyl-pentoxy)methyl]-10,13-dimethyl-2,3,4,9,11,12,14,15-octahydro-1H-cyclopenta[a]phenanthrene-1,3-diol

Systemtic Name:17-[(3-ethyl-3-oxidanyl-pentoxy)methyl]-10,13-dimethyl-2,3,4,9,11,12,14,15-octahydro-1H-cyclopenta[a]phenanthrene-1,3-diol
Openeye Name:17-[(3-ethyl-3-hydroxy-pentoxy)methyl]-10,13-dimethyl-2,3,4,9,11,12,14,15-octahydro-1H-cyclopenta[a]phenanthrene-1,3-diol
CAS Name:17-[(3-ethyl-3-hydroxypentoxy)methyl]-10,13-dimethyl-2,3,4,9,11,12,14,15-octahydro-1H-cyclopenta[a]phenanthrene-1,3-diol
IUPAC Name:17-[(3-ethyl-3-hydroxypentoxy)methyl]-10,13-dimethyl-2,3,4,9,11,12,14,15-octahydro-1H-cyclopenta[a]phenanthrene-1,3-diol
Traditional Name:17-[(3-ethyl-3-hydroxy-pentoxy)methyl]-10,13-dimethyl-2,3,4,9,11,12,14,15-octahydro-1H-cyclopenta[a]phenanthrene-1,3-diol
Formula: C27H42O4
MolecularWeight: 430.61998
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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(CCOCC1=CCC2C1(CCC3C2=CC=C4C3(C(CC(C4)O)O)C)C)O


Isomeric SMILES

CCC(CC)(CCOCC1=CCC2C1(CCC3C2=CC=C4C3(C(CC(C4)O)O)C)C)O


InChI

InChI=1S/C27H42O4/c1-5-27(30,6-2)13-14-31-17-19-8-10-22-21-9-7-18-15-20(28)16-24(29)26(18,4)23(21)11-12-25(19,22)3/h7-9,20,22-24,28-30H,5-6,10-17H2,1-4H3


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