input word = C00044800

Metabolite InformationStructural formula
Name Heliotropamide
(+)-Heliotropamide
Formula C36H36N2O8
Mw 624.24716614
CAS RN 646990-38-7
C_ID C00044800 ,
InChIKey VNFIQMCRAYEPSY-MDINWNTENA-N
InChICode InChI=1S/C36H36N2O8/c1-45-31-20-24(7-13-29(31)41)19-28-33(35(43)37-17-15-22-3-9-26(39)10-4-22)34(25-8-14-30(42)32(21-25)46-2)38(36(28)44)18-16-23-5-11-27(40)12-6-23/h3-14,19-21,33-34,39-42H,15-18H2,1-2H3,(H,37,43)/b28-19-/t33-,34+/m0/s1
SMILES COc1cc(/C=C2C(=O)N(CCc3ccc(O)cc3)[C@H](c3ccc(O)c(OC)c3)[C@H]2C(=O)NCCc2ccc(O)cc2)ccc1O
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
PlantaeBoraginaceaeHeliotropium ovalifolium Ref.
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