input word = C00001912

Metabolite InformationStructural formula
Name Rodiasine
Formula C38H42N2O6
Mw 622.30428709
CAS RN 6391-64-6
C_ID C00001912 ,
InChIKey PYHRGDRWMVEYQU-XLXAPLRVNA-N
InChICode InChI=1S/C38H42N2O6/c1-39-13-11-24-18-33(43-4)34-21-28(24)30(39)16-22-7-10-32(41)29(15-22)27-20-26(42-3)9-8-23(27)17-31-36-25(12-14-40(31)2)19-35(44-5)37(45-6)38(36)46-34/h7-10,15,18-21,30-31,41H,11-14,16-17H2,1-6H3/t30-,31+/m1/s1
SMILES c12c3c(c(c(c1)OC)OC)Oc1c(cc4c(c1)[C@H](N(CC4)C)Cc1ccc(c(c4cc(ccc4C[C@@H]3N(CC2)C)OC)c1)O)OC
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr L-Phe
Organism
Kingdom Family Species Reference
PlantaeLauraceaeOcotea rodiaei Ref.
PlantaeLauraceaeOcotea venenosa Ref.
zoom in