28-Demethyl -β-amyrone

CAS	73493-60-4
Synonyms	3-Oxo-28-norolean-12-ene
IUPAC Name	(4aR,6aR,6bS,8aR,12aR,14aR,14bR)-4,4,6a,6b,11,11,14b-heptamethyl-1,2,4a,5,6,7,8,8a,9,10,12,12a,14,14a-tetradecahydropicen-3-one
Molecular Weight	410.67
Molecular Formula	C29H46O
Canonical SMILES	C[C@]12CCC(=O)C([C@@H]1CC[C@@]3([C@@H]2CC=C4[C@]3(CC[C@@H]5[C@H]4CC(CC5)(C)C)C)C)(C)C
InChI	InChI=1S/C29H46O/c1-25(2)14-10-19-11-16-28(6)21(20(19)18-25)8-9-23-27(5)15-13-24(30)26(3,4)22(27)12-17-29(23,28)7/h8,19-20,22-23H,9-18H2,1-7H3/t19-,20-,22+,23-,27+,28-,29-/m1/s1
InChI Key	QQKXTWZLGUEVGX-DICJWPJSSA-N
Purity	98%
Appearance	Powder