InChI=1S/C27H46O2/c1-17(2)7-6-8-18(3)21-9-10-22-25-23(12-14-27(21,22)5)26(4)13-11-20(28)15-19(26)16-24(25)29/h16-18,20-25,28-29H,6-15H2,1-5H3/t18-,20+,21-,22+,23+,24-,25+,26+,27-/m1/s1

【InChIKey】

InChIKey=OYXZMSRRJOYLLO-RVOWOUOISA-N

【SMILES】

CC(C)CCC[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@@H](C=C4[C@@]3(CC[C@@H](C4)O)C)O)C

【MOL File】

5-CHOLESTEN-3BETA,7A….mol

2Chemical and Physical Properties

【Computed Properties】

H bond donor:2

H bond acceptor:2

XLogP3:7.0

Bulk/Fine:F

3Material Safety Data Sheet(MSDS)

4CML File

5-CHOLESTEN-3BETA,7ALPHA-DIOL.cml

Quick Release

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566-26-7 5-CHOLESTEN-3BETA,7ALPHA-DIOL

1Identification

【Name】

【CAS】

【MDL】

【English Synonyms】

【Formula】

【MolWeight】

【Inchi】