input word = C00046987

Metabolite InformationStructural formula
Name 17-Epiacnistin A
Formula C28H38O6
Mw 470.26683895
CAS RN 267003-44-1
C_ID C00046987 ,
InChIKey RNORCGKHUAMBKR-DJEVQHISNA-N
InChICode InChI=1S/C28H38O6/c1-23-13-18(19(14-23)33-22(30)26(23,4)31)27(32)11-8-16-15-12-21-28(34-21)9-5-6-20(29)25(28,3)17(15)7-10-24(16,27)2/h5-6,15-19,21,31-32H,7-14H2,1-4H3/t15-,16-,17-,18-,19+,21+,23+,24-,25-,26-,27-,28+/m0/s1
SMILES C[C@@]12C[C@@H](OC(=O)[C@]1(C)O)[C@@H]([C@@]1(O)CC[C@H]3[C@@H]4C[C@H]5O[C@]56CC=CC(=O)[C@]6(C)[C@H]4CC[C@@]31C)C2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaeDiscopodium penninervium Ref.
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OrganismDiscopodium penninervium
ReferenceHabtemariam,J.Nat.Prod.,63,(2000),512