mogroside IE
Chemical Formula:
C36H62O9
Molecular Weight:
638.88 Daltons
Monoisotopic Mass:
638.4393835891 Daltons
SMILES:
CC(CCC(O)C(O)(C)C)[CH]1(CCC5(C1(C)CC(O)C3(C)([CH](CC=C4(C(C)(C)C(OC2(OC(CO)C(O)C(O)C(O)2))CC[CH]34))5))C)
InChI:
1S/C36H62O9/c1-19(9-13-25(38)33(4,5)43)20-15-16-34(6)24-12-10-21-22(36(24,8)26(39)17-35(20,34)7)11-14-27(32(21,2)3)45-31-30(42)29(41)28(40)23(18-37)44-31/h10,19-20,22-31,37-43H,9,11-18H2,1-8H3/t19-,20-,22-,23-,24+,25-,26-,27+,28-,29+,30-,31+,34+,35-,36+/m1/s1
InChIKey:
Databases
MetaCyc:
CPD-20464
ChEBI:
138975
PubChem (CID):
101135271