input word = C00041741

Metabolite InformationStructural formula
Name Pervilleine A
Formula C30H37NO11
Mw 587.23666103
CAS RN 356758-74-2
C_ID C00041741 ,
InChIKey OWTUMFZGWWGYGZ-ORDYZARTNA-N
InChICode InChI=1S/C30H37NO11/c1-31-19-14-18(41-30(34)17-12-23(37-4)29(40-7)24(13-17)38-5)15-20(31)27(26(19)33)42-25(32)9-8-16-10-21(35-2)28(39-6)22(11-16)36-3/h8-13,18-20,26-27,33H,14-15H2,1-7H3/b9-8+/t18-,19-,20+,26+,27-/m0/s1
SMILES COc1cc(/C=C/C(=O)O[C@H]2[C@@H](O)[C@@H]3C[C@H](OC(=O)c4cc(OC)c(OC)c(OC)c4)C[C@H]2N3C)cc(OC)c1OC
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
PlantaeErythroxylaceaeErythroxylum pervilei Ref.
PlantaeErythroxylaceaeErythroxylum pervillei Ref.
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