Cholest-5-en-3-ol(3-beta),methylcarbonate

Catalog Number	ACM15507525-1
CAS Number	15507-52-5
Synonyms	3β-Hydroxy-5-cholestene 3-methyl carbonate
IUPAC Name	[(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] methyl carbonate
Molecular Weight	444.69
Molecular Formula	C29H48O3
Canonical SMILES	C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)OC(=O)OC)C)C
InChI	InChI=1S/C29H48O3/c1-19(2)8-7-9-20(3)24-12-13-25-23-11-10-21-18-22(32-27(30)31-6)14-16-28(21,4)26(23)15-17-29(24,25)5/h10,19-20,22-26H,7-9,11-18H2,1-6H3/t20-,22+,23+,24-,25+,26+,28+,29-/m1/s1
InChI Key	WHMGDIMLSAAHJQ-OHPSOFBHSA-N
Melting Point	114 ºC
Purity	98%+