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Amb4283577

Duplicate ID
Molecule Name 10,13-dimethyl-17-octyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3-thiol (non-preferred name)
SmilesCCCCCCCCC1CCC2C1(C)CCC1C2CC=C2C1(C)CCC(C2)S
InchiKeyXKCSBVSQDYCBQX-UHFFFAOYSA-N
InChi InChI=1S/C27H46S/c1-4-5-6-7-8-9-10-20-12-14-24-23-13-11-21-19-22(28)15-17-27(21,3)25(23)16-18-26(20,24)2/h11,20,22-25,28H,4-10,12-19H2,1-3H3
Formula C27H46S
Molecular weight 402.719
Rings 4
logP 8.6144
PSA 38.8
MR 130.382
Building Block
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