input word = C00027693

Metabolite InformationStructural formula
Name 15-Veratroylgermine
Germine 15-(3,4-dimethoxybenzoate)
Formula C36H51NO11
Mw 673.34621148
CAS RN 33352-59-9
C_ID C00027693 ,
InChIKey MVNXRPFXOHAQAN-UZRAMZEHNA-N
InChICode InChI=1S/C36H51NO11/c1-17-6-9-25-33(3,42)27-19(16-37(25)15-17)20-14-34-29(21(38)13-24-32(34,2)11-10-26(39)36(24,44)48-34)35(20,43)30(28(27)40)47-31(41)18-7-8-22(45-4)23(12-18)46-5/h7-8,12,17,19-21,24-30,38-40,42-44H,6,9-11,13-16H2,1-5H3/t17-,19-,20-,21+,24-,25-,26-,27+,28+,29+,30-,32-,33+,34+,35-,36+/m0/s1
SMILES COc1ccc(C(=O)O[C@H]2[C@H](O)[C@H]3[C@@H](CN4C[C@@H](C)CC[C@H]4[C@@]3(C)O)[C@@H]3C[C@@]45O[C@]6(O)[C@@H](C[C@@H](O)[C@H]4[C@@]32O)[C@]5(C)CC[C@@H]6O)cc1OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMelanthiaceaeVeratrum album ssp.lobelianum Ref.
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OrganismVeratrum album ssp.lobelianum
ReferenceTOmko,Farm.Obz.,50,(1981),115