input word = C00029075

Metabolite InformationStructural formula
Name Tatsiensine
Formula C27H39NO7
Mw 489.27265261
CAS RN 86695-18-3
C_ID C00029075 ,
InChIKey AARMMVPNMUKXKI-UHFFFAOYNA-N
InChICode InChI=1S/C27H39NO7/c1-7-28-12-24(3)9-8-18(31-5)26-16-10-15-17(30-4)11-25(19(16)20(15)32-6)27(23(26)28,34-13-33-25)22(21(24)26)35-14(2)29/h8-9,15-23H,7,10-13H2,1-6H3/t15-,16-,17-,18+,19-,20+,21+,22+,23-,24-,25-,26-,27+/m0/s1
SMILES N1(CC)C[C@]2([C@@H]3[C@@]4([C@H]1[C@]1([C@@H]3OC(=O)C)[C@]3([C@H]5[C@@H]4C[C@@H]([C@H](C3)OC)[C@H]5OC)OCO1)[C@@H](C=C2)OC)C
Start Substs in Alk. Biosynthesis (Prediction) Secologanin
Organism
Kingdom Family Species Reference
PlantaeRanunculaceaeDelphinium giraldii Ref.
PlantaeRanunculaceaeDelphinium kamaonense var.glabrescens Ref.
PlantaeRanunculaceaeDelphinium majus Ref.
PlantaeRanunculaceaeDelphinium siwanense var. leptogen Ref.
PlantaeRanunculaceaeDelphinium tatsienense Ref.
PlantaeRanunculaceaeDelphinium tatsiense Ref.
zoom in