input word = C00001640

Metabolite InformationStructural formula
Name Finaconitine
Formula C33H46N2O10
Mw 630.31524571
CAS RN 81161-27-5
C_ID C00001640 ,
InChIKey IUJWSEFNAUXHTB-APDBIZTHNA-N
InChICode InChI=1S/C33H46N2O10/c1-6-35-16-28(17-45-26(37)19-9-7-8-10-21(19)34-18(2)36)12-11-24(43-4)32-23(28)15-29(38,27(32)35)30(39)14-22(42-3)20-13-31(32,40)33(30,41)25(20)44-5/h7-10,20,22-25,27,38-41H,6,11-17H2,1-5H3,(H,34,36)/t20-,22+,23-,24+,25+,27-,28+,29-,30+,31-,32+,33+/m1/s1
SMILES C([C@]12[C@@H]3[C@@]4([C@H](CC1)OC)[C@]1([C@]5([C@@]([C@@](C3)([C@H]4N(C2)CC)O)(C[C@@H]([C@H]([C@@H]5OC)C1)OC)O)O)O)OC(=O)c1c(cccc1)NC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRanunculaceaeAconitum finetianum Ref.
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