input word = C00005102

Metabolite InformationStructural formula
Name Velloquercetin 3,3'-dimethyl ether
Formula C22H20O7
Mw 396.12090299
CAS RN 139955-65-0
C_ID C00005102 ,
InChIKey XMVZPOKNSODJHY-UHFFFAOYNA-N
InChICode InChI=1S/C22H20O7/c1-10(2)14-8-12-15(28-14)9-17-18(19(12)24)20(25)22(27-4)21(29-17)11-5-6-13(23)16(7-11)26-3/h5-7,9,14,23-24H,1,8H2,2-4H3/t14-/m0/s1
SMILES c12c(c(c3c(c1)oc(c(c3=O)OC)c1ccc(c(c1)OC)O)O)C[C@H](O2)C(=C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeVelloziaceaeVellozia stipitata Ref.
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