16α-Hydroxydehydrotrametenolic acid

CAS	176390-66-2
Synonyms	3beta,16alpha-Dihydroxylanosta-7,9(11),24-trien-21-oic acid
IUPAC Name	(2R)-2-[(3S,5R,10S,13R,14R,16R,17R)-3,16-dihydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-methylhept-5-enoic acid
Molecular Weight	470.68
Molecular Formula	C30H46O4
Canonical SMILES	CC(=CCC[C@H]([C@H]1[C@@H](C[C@@]2([C@@]1(CC=C3C2=CC[C@@H]4[C@@]3(CC[C@@H](C4(C)C)O)C)C)C)O)C(=O)O)C
InChI	InChI=1S/C30H46O4/c1-18(2)9-8-10-19(26(33)34)25-22(31)17-30(7)21-11-12-23-27(3,4)24(32)14-15-28(23,5)20(21)13-16-29(25,30)6/h9,11,13,19,22-25,31-32H,8,10,12,14-17H2,1-7H3,(H,33,34)/t19-,22-,23+,24+,25+,28-,29-,30+/m1/s1
InChI Key	XSLKAKROJKMHIT-WIUKAADNSA-N
Purity	98%
Appearance	Solid