InChI=1S/C27H44O2/c1-17(2)7-6-8-18(3)23-16-24(29)25-21-10-9-19-15-20(28)11-13-26(19,4)22(21)12-14-27(23,25)5/h17-20,22-23,28H,6-16H2,1-5H3/t18-,19+,20+,22?,23-,26+,27-/m1/s1

【InChIKey】

InChIKey=LINVVMHRTUSXHL-KNSPHKHNSA-N

【SMILES】

CC(C)CCC[C@@H](C)[C@H]1CC(=O)C2=C3CC[C@H]4C[C@H](CC[C@@]4(C3CC[C@]12C)C)O

【MOL File】

5ALPHA-CHOLEST-8(14)….mol

2Chemical and Physical Properties

【Computed Properties】

H bond donor:1

H bond acceptor:2

XLogP3:6.0

Bulk/Fine:FB

3Material Safety Data Sheet(MSDS)

4CML File

5ALPHA-CHOLEST-8(14)-EN-3BETA-OL-15-ONE.cml

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50673-97-7 5ALPHA-CHOLEST-8(14)-EN-3BETA-OL-15-ONE

1Identification

【Name】

【CAS】

【MDL】

【English Synonyms】

【Formula】

【MolWeight】

【Inchi】