input word = C00054748

Metabolite InformationStructural formula
Name 3,4-Dihydrolactupicrin
Formula C23H24O7
Mw 412.15220312
CAS RN 502463-82-3
C_ID C00054748
InChIKey PUUMACFYOWTVCM-JNRDVGFFSA-N
InChICode InChI=1S/C23H24O7/c1-11-7-17(29-18(27)8-13-3-5-15(25)6-4-13)20-12(2)23(28)30-22(20)21-14(10-24)9-16(26)19(11)21/h3-6,14,17,20-22,24-25H,2,7-10H2,1H3/t14-,17-,20+,21-,22-/m0/s1
SMILES C=C1C(=O)O[C@@H]2[C@@H]3C(=C(C)C[C@H](OC(=O)Cc4ccc(O)cc4)[C@@H]12)C(=O)C[C@H]3CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeCichorium spinosum Ref.
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