Curcurbitacin Iia

CAS	60137-06-6
Structure
Synonyms	(10α,24S)-16α,24-Epoxy-2,25-dihydroxy-9β-methyl-19-norlanosta-1,5-diene-3,11,22-trione
IUPAC Name	(1S,2S,4R,6S,9S,10R,11R,14R,15R)-17-hydroxy-6-(2-hydroxypropan-2-yl)-2,9,11,14,19,19-hexamethyl-5-oxapentacyclo[12.8.0.02,11.04,10.015,20]docosa-16,20-diene-8,13,18-trione
Molecular Weight	498.66
Molecular Formula	C30H42O6
Canonical SMILES	C[C@H]1[C@H]2[C@@H](C[C@@]3([C@@]2(CC(=O)[C@@]4([C@H]3CC=C5[C@H]4C=C(C(=O)C5(C)C)O)C)C)C)O[C@@H](CC1=O)C(C)(C)O
InChI	InChI=1S/C30H42O6/c1-15-18(31)12-23(27(4,5)35)36-20-13-28(6)21-10-9-16-17(11-19(32)25(34)26(16,2)3)30(21,8)22(33)14-29(28,7)24(15)20/h9,11,15,17,20-21,23-24,32,35H,10,12-14H2,1-8H3/t15-,17-,20-,21+,23+,24+,28+,29-,30+/m1/s1
InChI Key	MBYLRWSUZLFUTO-PQNVQGKDSA-N
Purity	98%
Density	1.22±0.1 g/ml
Appearance	Powder