input word = C00030148

Metabolite InformationStructural formula
Name Dipsanoside G
Formula C29H44O15
Mw 632.26802074
CAS RN 1013120-48-3
C_ID C00030148 ,
InChIKey HAOOAXFIOQPXIQ-JXNMOCNZNA-N
InChICode InChI=1S/C29H44O15/c1-6-13-14(8-20(37-3)38-4)17(11-41-28(13)44-29-24(33)23(32)22(31)19(9-30)43-29)25(34)42-18-7-15-16(12(18)2)10-40-27(36)21(15)26(35)39-5/h6,11-16,18-24,27-33,36H,1,7-10H2,2-5H3/t12-,13+,14+,15-,16+,18+,19-,21+,22+,23+,24-,27+,28+,29+/m1/s1
SMILES [C@@H]1(OC[C@@H]2[C@H]([C@H]1C(=O)OC)C[C@@H]([C@@H]2C)OC(=O)C1=CO[C@H]([C@H]([C@@H]1CC(OC)OC)C=C)O[C@@H]1O[C@@H]([C@@H]([C@@H]([C@H]1O)O)O)CO)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeDipsacaceae/Diervillaceae/Linnaeaceae/ValerianaceaeDipsacus asper Ref.
zoom in