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Amb1344231

Duplicate ID
CAS Number 1170779-35-7
Molecule Name 10,13-Dimethyl-16-[1-phenyl-meth-(E)-ylidene]-hexadecahydro-cyclopenta[a]phenanthren-17-one
SmilesO=C1/C(=C/c2ccccc2)/CC2C1(C)CCC1C2CCC2C1(C)CCCC2
InchiKeyBXEKJWVUCNPPSL-KNTRCKAVSA-N
InChi InChI=1S/C26H34O/c1-25-14-7-6-10-20(25)11-12-21-22(25)13-15-26(2)23(21)17-19(24(26)27)16-18-8-4-3-5-9-18/h3-5,8-9,16,20-23H,6-7,10-15,17H2,1-2H3/b19-16+
Formula C26H34O
Molecular weight 362.548
Rings 5
logP 6.6818
PSA 17.07
MR 114.283
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