input word = C00011784

Metabolite InformationStructural formula
Name Carmelin
Formula C19H26O6
Mw 350.17293856
CAS RN 56192-71-3
C_ID C00011784 ,
InChIKey OHMAVTDVTQMMMR-SZAADTLWNA-N
InChICode InChI=1S/C19H26O6/c1-10-6-7-15(23-13(4)20)11(2)9-17-18(12(3)19(22)25-17)16(8-10)24-14(5)21/h6,9,12,15-18H,7-8H2,1-5H3/b10-6-,11-9+/t12-,15+,16+,17-,18+/m1/s1
SMILES C1[C@@H](/C(=C/[C@@H]2[C@H]([C@H](C/C(=C\1)/C)OC(=O)C)[C@H](C(=O)O2)C)/C)OC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeStevia serrata Ref.
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