19Alpha-Hydroxyasiatic Acid

(1R,2R,4aS,6aR,6aS,6bR,8aR,9R,10R,11R,12aR,14bS)-1,10,11-trihydroxy-9-(hydroxymethyl)-1,2,6a,6b,9,12a-hexamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid

Also Known As: 19Alpha-Hydroxyasiatic Acid|Myrianthic acid|23-hydroxytormentic acid|meyanthic acid|19|A-Hydroxyasiatic acid|23-Hydroxytormenticacid|19 alpha-Hydroxyasiatic acid|3beta-Myrianthic acid|19?-hydroxyasiatic acid|23-hydroxy-tormentic acid|19??-Hydroxyasiatic acid|Niga-ichigoside F1 aglycone|19| cent-Hydroxyasiatic acid|HY-N8164|NP6531|NP7061|TN1197|SID:134224890|(1R,2R,4aS,6aR,6aS,6bR,8aR,9R,10R,11R,12aR,14bS)-1,10,11-trihydroxy-9-(hydroxymethyl)-1,2,6a,6b,9,12a-hexamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid|23-Hydroxytormentic acid, >=95% (LC/MS-ELSD)|(2alpha,3beta)-2,3,19,23-tetrahydroxyurs-12-en-28-oic acid|2alpha,3beta,19,23-Tetrahydroxyurs-12-en-28-oic acid|2+/-,3+/-,19,24-Tetrahydroxyurs-12-en-28-oic acid|2alpha,3alpha,19,24-Tetrahydroxyurs-12-en-28-oic acid|(2a,3b,4a)-2,3,19,23-Tetrahydroxyurs-12-en-28-oic acid|(4R)-2alpha,3beta,19,23-Tetrahydroxyurs-12-ene-28-oic acid|2alpha,3beta,19alpha,23-tetrahydroxy-urs-12-en-28-oic acid|2alpha,3beta,19alpha,23-Tetrahydroxyurs-12-ene-28-oic acid

Molecular Formula	C30H48O6
Molecular Weight	504.3451 g/mol
LogP	4.3
Topological Polar Surface Area	118.0 Ų
Hydrogen Bond Donors	5
Hydrogen Bond Acceptors	6
Rotatable Bonds	2
Exact Mass	504.3451
Monoisotopic Mass	504.3451
Heavy Atoms	36
Complexity	978.0

Chemical Identifiers

CAS Number	89786-84-5
SMILES	C[C@@H]1CC[C@@]2(CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(C[C@H]([C@@H]([C@@]5(C)CO)O)O)C)C)[C@@H]2[C@]1(C)O)C)C(=O)O
InChIKey	YCOKATFNRPZIIU-NIZSJLHKSA-N