ginsenoside Rb1
Chemical Formula:
C54H92O23
Molecular Weight:
1109.307 Daltons
Monoisotopic Mass:
1108.6029392615 Daltons
SMILES:
CC(C)=CCCC(C)(OC2(C(O)C(C(O)C(COC1(C(O)C(O)C(O)C(CO)O1))O2)O))[CH]3(CCC4([CH]3C(O)C[CH]5(C4(C)CC[CH]6(C5(C)CCC(C(C)(C)6)OC7(C(C(C(O)C(CO)O7)O)OC8(C(O)C(C(O)C(CO)O8)O)))))C)
InChI:
1S/C54H92O23/c1-23(2)10-9-14-54(8,77-48-44(69)40(65)37(62)29(74-48)22-70-46-42(67)38(63)34(59)26(19-55)71-46)24-11-16-53(7)33(24)25(58)18-31-51(5)15-13-32(50(3,4)30(51)12-17-52(31,53)6)75-49-45(41(66)36(61)28(21-57)73-49)76-47-43(68)39(64)35(60)27(20-56)72-47/h10,24-49,55-69H,9,11-22H2,1-8H3/t24-,25+,26+,27+,28+,29+,30-,31+,32-,33-,34+,35+,36+,37+,38-,39-,40-,41-,42+,43+,44+,45+,46+,47-,48-,49-,51-,52+,53+,54-/m0/s1
InChIKey:
Databases
MetaCyc:
CPD-9250
KEGG:
C20713
PubChem (CID):
9898279
MetaboLights:
MTBLC67989
DRUGBANK:
DB06749
ChEBI:
67989
RefMet:
Ginsenoside Rb1
Seed:
cpd25618
HMDB:
HMDB35892
MetaNetX:
MNXM105360