input word = C00038962

Metabolite InformationStructural formula
Name Delavaconine
Formula C22H35NO5
Mw 393.25152324
CAS RN 1356-51-0
C_ID C00038962 ,
InChIKey HDJXHFQXBLLNBR-UHFFFAOYNA-N
InChICode InChI=1S/C22H35NO5/c1-4-23-10-11-5-6-15(27-2)22-12(11)7-13(18(22)23)20(25)9-16(28-3)21(26)8-14(22)17(20)19(21)24/h11-19,24-26H,4-10H2,1-3H3/t11-,12+,13-,14+,15-,16+,17+,18+,19-,20-,21-,22-/m0/s1
SMILES CCN1CC2CCC(OC)C34C2CC(C13)C1(O)CC(OC)C2(O)CC4C1C2O
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Arg Secologanin
Organism
Kingdom Family Species Reference
PlantaeRanunculaceaeAconitum toxicum Ref.
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