oleanolate 3-β-D-glucuronoside-28-glucoside
Chemical Formula:
C42H65O14
Molecular Weight:
793.967 Daltons
Monoisotopic Mass:
794.445256828 Daltons
SMILES:
CC3(C[CH]4(C2(=CC[CH]6(C1(CCC(C([CH]1CCC(C2(CCC(CC3)4C(OC5(C(C(C(C(CO)O5)O)O)O))=O)C)6C)(C)C)OC7(C(C(C([CH](C([O-])=O)O7)O)O)O))C))))C
InChI:
1S/C42H66O14/c1-37(2)14-16-42(36(52)56-34-30(48)27(45)26(44)22(19-43)53-34)17-15-40(6)20(21(42)18-37)8-9-24-39(5)12-11-25(38(3,4)23(39)10-13-41(24,40)7)54-35-31(49)28(46)29(47)32(55-35)33(50)51/h8,21-32,34-35,43-49H,9-19H2,1-7H3,(H,50,51)/p-1/t21-,22+,23-,24+,25-,26+,27-,28-,29-,30+,31+,32-,34-,35+,39-,40+,41+,42-/m0/s1
InChIKey:
Databases
MetaCyc:
CPD-9462
PubChem (CID):
90658901
Seed:
cpd25691
ChEBI:
67977
MetaNetX:
MNXM12515