ginsenoside Rf
Chemical Formula:
C42H72O14
Molecular Weight:
801.02 Daltons
Monoisotopic Mass:
800.4922070206 Daltons
SMILES:
CC(C)=CCC[C@@]([C@H]1([C@H]4([C@@](C)(CC1)[C@]5(C)(C[C@H](O[C@@H]3([C@H](O[C@@H]2([C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2))[C@@H](O)[C@H](O)[C@@H](CO)O3))[C@@H]6(C([C@@H](O)CC[C@](C)([C@@H](C[C@@H](O)4)5)6)(C)C)))))(O)C
InChI:
1S/C42H72O14/c1-20(2)10-9-13-42(8,52)21-11-15-40(6)28(21)22(45)16-26-39(5)14-12-27(46)38(3,4)35(39)23(17-41(26,40)7)53-37-34(32(50)30(48)25(19-44)55-37)56-36-33(51)31(49)29(47)24(18-43)54-36/h10,21-37,43-52H,9,11-19H2,1-8H3/t21-,22+,23-,24+,25+,26+,27-,28-,29+,30+,31-,32-,33+,34+,35-,36-,37+,39+,40+,41+,42-/m0/s1
InChIKey:
Databases
MetaCyc:
CPD-15441
ChEBI:
67986
HMDB:
HMDB34745
KEGG:
C08945
MetaboLights:
MTBLC67986
PubChem (CID):
441922
Seed:
cpd05841
MetaNetX:
MNXM105362