| Name(s) |
uralsaponin q |
| Scientific name(s) |
unii-ns2dfk8u3y; ns2dfk8u3y; (3beta,20beta,21alpha)-20-carboxy-21-hydroxy-11-oxo-30-norolean-12-en-3-yl o-6-deoxy-alpha-l-mannopyranosyl-(1->2)-o-beta-d-xylopyranosyl-(1->2)-beta-d-glucopyranosiduronic acid; 3beta-o-(alpha-l-rhamnopyranosyl-(1->2)-beta-d-xylopyranosyl-(1->2)-beta-d-glucuronopyranosyl)-21alpha-hydroxy-11-oxo-olean-12-en-30-oic acid; beta-d-glucopyranosiduronic acid, (3beta,20beta,21alpha)-20-carboxy-21-hydroxy-11-oxo-30-norolean-12-en-3-yl o-6-deoxy-alpha-l-mannopyranosyl-(1->2)-o-beta-d-xylopyranosyl-(1->2)- |
| Formula |
C47H72O19 |
| Molecular mass |
941.1 |
| IUPAC name |
(2S,3S,4S,5R,6R)-6-[[(3S,4aR,6aR,6bS,8aS,10R,11R,12aR,14aR,14bS)-11-carboxy-10-hydroxy-4,4,6a,6b,8a,11,14b-heptamethyl-14-oxo-2,3,4a,5,6,7,8,9,10,12,12a,14a-dodecahydro-1H-picen-3-yl]oxy]-5-[(2S,3R,4S,5R)-4,5-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxyoxane-2-carboxylic acid |
| INCHI |
InChI=1S/C47H72O19/c1-19-27(51)29(53)32(56)38(62-19)65-34-28(52)23(49)18-61-39(34)66-35-31(55)30(54)33(37(57)58)64-40(35)63-26-10-11-44(5)24(42(26,2)3)9-12-47(8)36(44)22(48)15-20-21-16-45(6,41(59)60)25(50)17-43(21,4)13-14-46(20,47)7/h15,19,21,23-36,38-40,49-56H,9-14,16-18H2,1-8H3,(H,57,58)(H,59,60)/t19-,21-,23+,24-,25+,26-,27-,28-,29+,30-,31-,32+,33-,34+,35+,36+,38-,39-,40+,43-,44-,45+,46+,47+/m0/s1 |
| SMILE |
Not available |
| CAS ID |
1616062-82-8 |
| PubChem ID |
162623540 |
| DrugBank ID |
Not available |
| CHEBI ID |
Not available |
