input word = C00029202

Metabolite InformationStructural formula
Name Veratrine
Formula C36H51NO11
Mw 673.34621148
CAS RN 71-62-5
C_ID C00029202 ,
InChIKey FVECELJHCSPHKY-SSHKLNCXNA-N
InChICode InChI=1S/C36H51NO11/c1-19-6-11-26-31(3,40)35(43)25(17-37(26)16-19)33(42)18-34-24(32(33,41)15-27(35)38)10-9-23-30(34,2)13-12-28(36(23,44)48-34)47-29(39)20-7-8-21(45-4)22(14-20)46-5/h7-8,14,19,23-28,38,40-44H,6,9-13,15-18H2,1-5H3/t19-,23-,24-,25-,26-,27-,28-,30-,31+,32+,33+,34+,35-,36-/m0/s1
SMILES [C@]123O[C@@]4([C@H](CC[C@]1([C@@H]4CC[C@H]2[C@]1([C@@](C3)([C@H]2[C@]([C@H](C1)O)([C@@]([C@H]1N(C2)C[C@H](CC1)C)(O)C)O)O)O)C)OC(=O)c1ccc(c(c1)OC)OC)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMelanthiaceaeVeratrum lobelianum Ref.
PlantaeMelanthiaceaeVeratrum viride Ait. Ref.
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