input word = C00011752

Metabolite InformationStructural formula
Name 4,5-Dihydromelampodin B
Formula C17H20O7
Mw 336.12090299
CAS RN 56650-68-1
C_ID C00011752 ,
InChIKey GJZCYYPVEVTANZ-CITUUCFNNA-N
InChICode InChI=1S/C17H20O7/c1-8-15-13(23-16(8)20)5-10(7-18)3-4-12(22-9(2)19)11-6-14(15)24-17(11)21/h6,10,12-15,18H,1,3-5,7H2,2H3/t10-,12+,13+,14-,15-/m1/s1
SMILES [C@H]12[C@H]([C@H]3C=C(C(=O)O3)[C@H](CC[C@H](C2)CO)OC(=O)C)C(=C)C(=O)O1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeMelampodium cinereum Ref.
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