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=C[C@H]1[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)O[C@H]2C[C@H]3[C@H](COC(O)[C@@H]3C(=O)OC)[C@H]2C)[C@H]1CC(OC)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeDipsacaceae/Diervillaceae/Linnaeaceae/ValerianaceaeDipsacus asper Ref.
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