| SpectraBase Spectrum ID |
GRvJJswTMYG |
| Name |
12,13-Dihydroursolic Acid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C30H50O3 |
| InChI |
InChI=1S/C30H50O3/c1-18-10-15-30(25(32)33)17-16-28(6)20(24(30)19(18)2)8-9-22-27(5)13-12-23(31)26(3,4)21(27)11-14-29(22,28)7/h18-24,31H,8-17H2,1-7H3,(H,32,33)/t18-,19+,20?,21?,22?,23+,24?,27+,28-,29-,30+/m1/s1 |
| InChIKey |
USGWNZHHTABDDB-XUSUYOPNSA-N |
| Molecular Weight |
458.727 g/mol |
| SMILES |
O[C@]1(CC[C@@]2(C3[C@]([C@@]4(CC[C@@]5(C(=O)O)CC[C@]([C@@](C5C4CC3)(C)[H])(C)[H])C)(CCC2C1(C)C)C)C)[H] |
| SPLASH |
splash10-0a4i-9200100000-7f843bfb870f75ba96cb |
| Source of Spectrum |
X2-52-61-5 |
| Synonyms |
(3beta)-3-hydroxyursan-28-oic acid
(1S,2R,4aS,6aR,6bR,10S,12aR)-1,2,6a,6b,9,9,12a-heptamethyl-10-oxidanyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14,14a,14b-hexadecahydro-1H-picene-4a-carboxylic acid |
| Wiley ID |
1603005 |
