input word = C00040657

Metabolite InformationStructural formula
Name Withangulatin F
(+)-Withangulatin F
Formula C28H38O6
Mw 470.26683895
CAS RN 946074-82-4
C_ID C00040657 ,
InChIKey RROCKISJMKXBMJ-AFMFFGJPNA-N
InChICode InChI=1S/C28H36O6/c1-15-13-21(33-23(30)16(15)2)26(5,31)19-9-12-27(32)18-14-22-28(34-22)10-6-7-20(29)25(28,4)17(18)8-11-24(19,27)3/h6-7,9,17-18,21-22,31-32H,8,10-14H2,1-5H3/t17-,18+,21-,22+,24+,25-,26+,27+,28+/m0/s1
SMILES CC1=C(C)C(=O)O[C@H]([C@](C)(O)C2=CC[C@@]3(O)[C@@H]4C[C@H]5O[C@]56CC=CC(=O)[C@]6(C)[C@H]4CC[C@]23C)C1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaePhysalis angulata Ref.
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