input word = C00001627

Metabolite InformationStructural formula
Name Condelphine
Kondelfin
Formula C25H39NO6
Mw 449.27773799
CAS RN 7633-69-4
C_ID C00001627 ,
InChIKey ZEBMMHUDQRRILP-KSFYFMJLNA-N
InChICode InChI=1S/C25H39NO6/c1-5-26-11-23(12-30-3)7-6-19(28)25-15-8-14-17(31-4)10-24(29,16(22(25)26)9-18(23)25)20(15)21(14)32-13(2)27/h14-22,28-29H,5-12H2,1-4H3/t14-,15-,16+,17+,18-,19+,20-,21+,22-,23+,24+,25-/m1/s1
SMILES C([C@]12[C@@H]3[C@@]4([C@H](CC1)O)[C@H]1[C@H]5[C@@]([C@@H](C3)[C@H]4N(C2)CC)(C[C@@H]([C@H]([C@@H]5OC(=O)C)C1)OC)O)OC
Start Substs in Alk. Biosynthesis (Prediction) L-Arg Secologanin
Organism
Kingdom Family Species Reference
PlantaeRanunculaceaeAconitum deiphinifolium Ref.
PlantaeRanunculaceaeAconitum delphinifolium Ref.
PlantaeRanunculaceaeDelphinium confusum Ref.
PlantaeRanunculaceaeDelphinium denudatum Ref.
PlantaeRanunculaceaeDelphinium nuttallianum Pritz. Ref.
PlantaeRanunculaceaeDelphinium pyrimadale Ref.
PlantaeRanunculaceaeDelphinium uncinatum Hook f.and Thomas Ref.
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OrganismDelphinium pyrimadale
ReferenceUlubelen,Phytochem.,48,(1998),385