24,25-Dihydroxycycloartan-3-One

Catalog	BBC155060483
CAS	155060-48-3
Structure
Synonyms	9,19-Cyclolanostan-3-one, 24,25-dihydroxy-, (24R)-
IUPAC Name	(1S,3R,8R,11S,12S,15R,16R)-15-[(2R,5R)-5,6-dihydroxy-6-methylheptan-2-yl]-7,7,12,16-tetramethylpentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-one
Molecular Weight	458.72
Molecular Formula	C30H50O3
Canonical SMILES	C[C@H](CC[C@H](C(C)(C)O)O)[C@H]1CC[C@@]2([C@@]1(CC[C@]34[C@H]2CC[C@@H]5[C@]3(C4)CCC(=O)C5(C)C)C)C
InChI	InChI=1S/C30H50O3/c1-19(8-11-24(32)26(4,5)33)20-12-14-28(7)22-10-9-21-25(2,3)23(31)13-15-29(21)18-30(22,29)17-16-27(20,28)6/h19-22,24,32-33H,8-18H2,1-7H3/t19-,20-,21+,22+,24-,27-,28+,29-,30+/m1/s1
InChI Key	JCGYBQRUVSZLCH-FDIVVELCSA-N
Boiling Point	570.6±20.0 °C
Purity	98%
Density	1.08±0.1 g/ml
Appearance	Solid
pKa	14.67±0.29