input word = C00013502

Metabolite InformationStructural formula
Name Oxyisocyclointegrin
6,7-Dihydro-3,9-dihydroxy-6-(1-hydroxy-1-methylethyl)-11-methoxy-8H-[1]benzopyrano[3,2-d][1]benzoxepin-8-one
Formula C21H20O7
Mw 384.12090299
CAS RN 60791-47-1
C_ID C00013502 ,
InChIKey CLBXZXANZHXYLN-UHFFFAOYNA-N
InChICode InChI=1S/C21H20O7/c1-21(2,25)17-9-13-19(24)18-14(23)7-11(26-3)8-16(18)28-20(13)12-5-4-10(22)6-15(12)27-17/h4-8,17,22-23,25H,9H2,1-3H3/t17-/m1/s1
SMILES c12c(oc3c(c1=O)C[C@@H](Oc1c3ccc(c1)O)C(C)(C)O)cc(cc2O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMoraceaeArtocarpus integer Ref.
PlantaeMoraceaeArtocarpus integrifolia Ref.
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