input word = C00002478

Metabolite InformationStructural formula
Name Isosamidin
Formula C21H22O7
Mw 386.13655306
CAS RN 53023-18-0
C_ID C00002478 ,
InChIKey VPDWBGHNQKUFNN-YLBUIOQXNA-N
InChICode InChI=1S/C21H22O7/c1-11(2)10-16(24)27-19-17-14(28-21(4,5)20(19)25-12(3)22)8-6-13-7-9-15(23)26-18(13)17/h6-10,19-20H,1-5H3/t19-,20-/m1/s1
SMILES c1c2c(c3c(c1)ccc(=O)o3)[C@@H](OC(=O)C=C(C)C)[C@@H](OC(=O)C)C(O2)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeAngelica mori Ref.
PlantaeApiaceaeSeseli gummiferum Ref.
PlantaeApiaceaeSeseli tortuosum Ref.
PlantaeApiaceaeZizia aptera Ref.
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OrganismSeseli gummiferum
ReferenceHarborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter35