input word = C00027496

Metabolite InformationStructural formula
Name Tiliacosine
Formula C37H38N2O7
Mw 622.26790158
CAS RN 412913-17-8
C_ID C00027496 ,
InChIKey IHQOZBMVZWKCOR-OBXPXUJENA-N
InChICode InChI=1S/C37H38N2O7/c1-38-10-8-21-17-30-31-18-23(21)26(38)15-20-13-25(33(41)28(40)16-20)24-12-19(6-7-29(24)42-3)14-27-32-22(9-11-39(27)2)34(43-4)36(44-5)37(46-30)35(32)45-31/h6-7,12-13,16-18,26-27,40-41H,8-11,14-15H2,1-5H3/t26-,27-/m0/s1
SMILES c1(c2c3c4c(c1OC)Oc1c(O4)cc4c(c1)CCN([C@H]4Cc1cc(c4c(ccc(C[C@@H]3N(CC2)C)c4)OC)c(c(c1)O)O)C)OC
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
PlantaeMenispermaceaeTiliacora racemosa Ref.
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OrganismTiliacora racemosa
ReferenceSeal,Nat.Prod.Sci.,7,(2001),83