input word = C00025187

Metabolite InformationStructural formula
Name Longicaudatine
NSC 377102
Formula C38H40N4O
Mw 568.32021193
CAS RN 85335-06-4
C_ID C00025187 ,
InChIKey PTRWWFKHWVYDOM-AIZGRBPTNA-N
InChICode InChI=1S/C38H40N4O/c1-2-22-19-40-14-11-25-24-7-3-5-9-30(24)39-35(25)32(40)17-26(22)28-21-42-31-10-6-4-8-29(31)38-13-15-41-20-23-12-16-43-36(28)34(37(38)42)27(23)18-33(38)41/h2-10,12,21,26-27,32-34,36-37,39H,11,13-20H2,1H3/b22-2+/t26-,27-,32-,33-,34-,36+,37-,38+/m0/s1
SMILES c1ccc2c(c1)[C@@]13[C@H]4N2C=C([C@@H]2[C@@H]4[C@H]4C[C@@H]1N(CC3)CC4=CCO2)[C@@H]1/C(=C/C)/CN2[C@@H](C1)c1c(CC2)c2c([nH]1)cccc2
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Secologanin
Organism
Kingdom Family Species Reference
PlantaeLonganiaceaeStrychnos ignatti Berg. Ref.
zoom in