Alisol E 23-Acetate

Catalog	BBC155301589
CAS	155301-58-9
Structure
Synonyms	(8alpha,9beta,11beta,14beta,23S,24S)-23-(Acetyloxy)-11,24,25-trihydroxydammar-13(17)-en-3-one
IUPAC Name	[(3S,4S,6R)-2,3-dihydroxy-6-[(5R,8S,9S,10S,11S,14R)-11-hydroxy-4,4,8,10,14-pentamethyl-3-oxo-1,2,5,6,7,9,11,12,15,16-decahydrocyclopenta[a]phenanthren-17-yl]-2-methylheptan-4-yl] acetate
Molecular Weight	532.76
Molecular Formula	C32H52O6
Canonical SMILES	C[C@H](C[C@@H]([C@@H](C(C)(C)O)O)OC(=O)C)C1=C2C[C@@H]([C@H]3[C@]4(CCC(=O)C([C@@H]4CC[C@@]3([C@]2(CC1)C)C)(C)C)C)O
InChI	InChI=1S/C32H52O6/c1-18(16-23(38-19(2)33)27(36)29(5,6)37)20-10-14-31(8)21(20)17-22(34)26-30(7)13-12-25(35)28(3,4)24(30)11-15-32(26,31)9/h18,22-24,26-27,34,36-37H,10-17H2,1-9H3/t18-,22+,23+,24+,26+,27+,30+,31+,32+/m1/s1
InChI Key	KRZLECBBHPYBFK-GLHMJAHESA-N
Purity	98%
Appearance	Solid