input word = C00012098

Metabolite InformationStructural formula
Name Dihydroelephantopin
Formula C19H22O7
Mw 362.13655306
CAS RN 70168-65-9
C_ID C00012098 ,
InChIKey QSWYQLKLSFXCHO-UNDFPRFCNA-N
InChICode InChI=1S/C19H22O7/c1-8(2)16(20)24-12-6-10-5-11(23-18(10)22)7-19(4)15(26-19)14-13(12)9(3)17(21)25-14/h5,8,11-15H,3,6-7H2,1-2,4H3/t11-,12-,13+,14-,15+,19+/m0/s1
SMILES C=C1C(=O)O[C@H]2C1[C@@H](OC(=O)C(C)C)CC1=C[C@@H](C[C@@]3(C)O[C@H]23)OC1=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeElephantopus tomentosus Ref.
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