input word = C00031491

Metabolite InformationStructural formula
Name 10-O-E-Feruloylmonotropein
(-)-10-O-E-Feruloylmonotropein
Formula C26H30O14
Mw 566.16355567
CAS RN 836674-93-2
C_ID C00031491 ,
InChIKey UKPFDLLNOGQHNP-XZMOMYEGNA-N
InChICode InChI=1S/C26H30O14/c1-36-16-8-12(2-4-15(16)28)3-5-18(29)38-11-26(35)7-6-13-14(23(33)34)10-37-24(19(13)26)40-25-22(32)21(31)20(30)17(9-27)39-25/h2-8,10,13,17,19-22,24-25,27-28,30-32,35H,9,11H2,1H3,(H,33,34)/b5-3+/t13-,17+,19+,20+,21-,22+,24-,25-,26+/m0/s1
SMILES C1=C([C@H]2[C@H]([C@@H](O1)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)[C@@](C=C2)(COC(=O)/C=C/c1ccc(c(c1)OC)O)O)C(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRubiaceaePaederia scandens Ref.
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