input word = C00040988

Metabolite InformationStructural formula
Name Glinuside D
(+)-Glinuside D
Formula C47H80O16
Mw 900.54463651
CAS RN 221468-19-5
C_ID C00040988 ,
InChIKey XAJCDULOYMUKSG-RCYQZPRRNA-N
InChICode InChI=1S/C47H80O16/c1-21-31(51)33(53)36(56)40(59-21)62-38-25(19-48)60-41(37(57)34(38)54)63-43(4,5)22-12-15-45(7)28-11-10-27-44(6)16-14-29(61-39-35(55)32(52)24(50)20-58-39)42(2,3)26(44)13-17-46(27,8)47(28,9)18-23(49)30(22)45/h21-41,48-57H,10-20H2,1-9H3/t21-,22+,23-,24-,25+,26+,27+,28+,29-,30+,31-,32-,33+,34+,35+,36+,37+,38-,39-,40-,41-,44+,45+,46+,47+/m0/s1
SMILES C1[C@@]2([C@@H](C([C@H](C1)O[C@@H]1OC[C@@H]([C@@H]([C@H]1O)O)O)(C)C)CC[C@@]1([C@@H]2CC[C@H]2[C@]1(C[C@@H]([C@@H]1[C@@]2(CC[C@H]1C(O[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O[C@@H]1O[C@H]([C@@H]([C@H]([C@H]1O)O)O)C)O)O)(C)C)C)O)C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Glimus lotoides var. dictamnoides Ref.
zoom in



OrganismGlimus lotoides var. dictamnoides
ReferenceHamed,Phytochem.,50,(1999),477