Acetylsventenic Acid

CAS	126737-42-6
Synonyms	(4beta,7beta)-7-(Acetyloxy)-kaur-16-en-18-oic acid
IUPAC Name	(1R,2S,4S,5S,9S,10S,13R)-2-acetyloxy-5,9-dimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylic acid
Molecular Weight	360.49
Molecular Formula	C22H32O4
Canonical SMILES	CC(=O)OC1CC2C(CCCC2(C)C(=O)O)(C3C14CC(CC3)C(=C)C4)C
InChI	InChI=1S/C22H32O4/c1-13-11-22-12-15(13)6-7-16(22)20(3)8-5-9-21(4,19(24)25)17(20)10-18(22)26-14(2)23/h15-18H,1,5-12H2,2-4H3,(H,24,25)/t15-,16+,17+,18+,20+,21+,22+/m1/s1
InChI Key	OTGKWSJHAGHYIW-RNXAVOFCSA-N
Boiling Point	475.1±45.0 °C
Purity	98%
Density	1.15±0.1 g/ml
pKa	4.55±0.60
Appearance	Solid