input word = C00051869

Metabolite InformationStructural formula
Name 7-O-Methyl-N-deacetylipecoside
Formula C27H37NO10
Mw 535.24174641
CAS RN
C_ID C00051869
InChIKey
InChICode InChI=1S/C27H37NO10/c1-4-14-17(10-18-16-11-21(35-2)19(30)9-13(16)7-8-28-18)15(26(34)36-3)5-6-20(14)37-27-25(33)24(32)23(31)22(12-29)38-27/h4-5,9,11,14,17-18,20,22-25,27-33H,1,6-8,10,12H2,2-3H3/t14-,17+,18-,20-,22-,23-,24+,25-,27-/m1/s1
SMILES c1(c(cc2c(c1)CCN[C@@H]2C[C@@H]1C(=CC[C@H]([C@@H]1C=C)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)C(=O)OC)OC)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRubiaceaePsychotria ipecacuanha Ref.
PlantaeRubiaceaePsychotria klugii Ref.
zoom in