input word = C00019154

Metabolite InformationStructural formula
Name Indicanine A
4-Hydroxy-5,4'-dimethoxy-5''-(1-methylethenyl)-4'',5''-dihydrofurano[2'',3'':7,6]-3-phenylcoumarin
Formula C22H20O6
Mw 380.12598837
CAS RN 274676-78-7
C_ID C00019154 ,
InChIKey ZDCJFDSEGJQOLJ-UHFFFAOYNA-N
InChICode InChI=1S/C22H20O6/c1-11(2)15-9-14-16(27-15)10-17-19(21(14)26-4)20(23)18(22(24)28-17)12-5-7-13(25-3)8-6-12/h5-8,10,15,23H,1,9H2,2-4H3/t15-/m1/s1
SMILES C=C(C)C1Cc2c(cc3oc(=O)c(-c4ccc(OC)cc4)c(O)c3c2OC)O1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeErythrina indica Ref.
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