input word = C00025444

Metabolite InformationStructural formula
Name Vepridimerine C
Formula C34H38N2O8
Mw 602.26281621
CAS RN 82841-72-3
C_ID C00025444 ,
InChIKey DKVZWAZZZIUTSY-UHFFFAOYNA-N
InChICode InChI=1S/C34H38N2O8/c1-33(2)24-18(22-27(37)16-10-12-20(39-6)29(41-8)25(16)36(5)32(22)44-33)14-34(3)15-19(24)23-28(43-34)17-11-13-21(40-7)30(42-9)26(17)35(4)31(23)38/h10-13,18-19,24H,14-15H2,1-9H3/t18-,19-,24+,34-/m0/s1
SMILES c12n(c3c(c(=O)c1ccc(c2OC)OC)[C@H]1[C@@H](C(O3)(C)C)[C@@H]2c3c(=O)n(c4c(c(ccc4c3O[C@@](C)(C1)C2)OC)OC)C)C
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr L-Phe
Organism
Kingdom Family Species Reference
PlantaeRutaceaeOricia renieri Ref.
PlantaeRutaceaeVepris louisii Ref.
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