6-[3-(hydroxymethyl)-4-oxidanyl-but-2-enyl]-7-oxidanyl-3-(6-oxidanyl-1,3-benzodioxol-5-yl)chromen-2-one

Systemtic Name: 6-[3-(hydroxymethyl)-4-oxidanyl-but-2-enyl]-7-oxidanyl-3-(6-oxidanyl-1,3-benzodioxol-5-yl)chromen-2-one Openeye Name: 7-hydroxy-3-(6-hydroxy-1,3-benzodioxol-5-yl)-6-[4-hydroxy-3-(hydroxymethyl)but-2-enyl]chromen-2-one CAS Name: 7-hydroxy-3-(6-hydroxy-1,3-benzodioxol-5-yl)-6-[4-hydroxy-3-(hydroxymethyl)but-2-enyl]-1-benzopyran-2-one IUPAC Name: 7-hydroxy-3-(6-hydroxy-1,3-benzodioxol-5-yl)-6-[4-hydroxy-3-(hydroxymethyl)but-2-enyl]chromen-2-one Traditional Name: 7-hydroxy-3-(6-hydroxy-1,3-benzodioxol-5-yl)-6-(4-hydroxy-3-methylol-but-2-enyl)coumarin Formula: C21H18O8 MolecularWeight: 398.36282

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C3=CC4=CC(=C(C=C4OC3=O)O)CC=C(CO)CO)O

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)C3=CC4=CC(=C(C=C4OC3=O)O)CC=C(CO)CO)O

InChI

InChI=1S/C21H18O8/c22-8-11(9-23)1-2-12-3-13-4-15(21(26)29-18(13)6-16(12)24)14-5-19-20(7-17(14)25)28-10-27-19/h1,3-7,22-25H,2,8-10H2