input word = C00028174

Metabolite InformationStructural formula
Name Diacetylheteratisine
Formula C26H37NO7
Mw 475.25700254
CAS RN 198422-45-6
C_ID C00028174 ,
InChIKey XWTOQFOAWBQDQN-DBAKAOJZNA-N
InChICode InChI=1S/C26H37NO7/c1-6-27-12-24(4)9-8-17(31-5)26-16-11-15-7-10-25(34-14(3)29,18(16)23(30)33-15)19(22(26)27)20(21(24)26)32-13(2)28/h15-22H,6-12H2,1-5H3/t15-,16+,17-,18+,19+,20-,21?,22-,24-,25-,26+/m0/s1
SMILES CCN1C[C@]2(C)CC[C@H](OC)C34C1C([C@@H](OC(C)=O)[C@@H]32)[C@@]1(OC(C)=O)CC[C@H]2C[C@@H]4[C@@H]1C(=O)O2
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Arg Cholesterol
Organism
Kingdom Family Species Reference
PlantaeRanunculaceaeAconitum pulchellum Hand-Mazz Ref.
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