input word = C00055444

Metabolite InformationStructural formula
Name 2,3-Dehydrosilychristin
Formula C25H20O10
Mw 480.10564686
CAS RN 57499-41-9
C_ID C00055444
InChIKey SFNRHEPTJDJBPD-FATZIPQQSA-N
InChICode InChI=1S/C25H20O10/c1-33-18-6-10(2-3-15(18)28)23-14(9-26)13-4-11(5-17(30)25(13)35-23)24-22(32)21(31)20-16(29)7-12(27)8-19(20)34-24/h2-8,14,23,26-30,32H,9H2,1H3/t14-,23+/m1/s1
SMILES O=C1C(O)=C(C2=CC(O)=C(O[C@@]([H])(C3=CC(OC)=C(O)C=C3)[C@@H]4CO)C4=C2)OC5=CC(O)=CC(O)=C51
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeSilybum marianum anatolicum Ref.
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