8-[(1S,2R)-3-methyl-1,2,3-tris(oxidanyl)butyl]-7-oxidanyl-chromen-2-one

Systemtic Name: 8-[(1S,2R)-3-methyl-1,2,3-tris(oxidanyl)butyl]-7-oxidanyl-chromen-2-one Openeye Name: 7-hydroxy-8-[(1S,2R)-1,2,3-trihydroxy-3-methyl-butyl]chromen-2-one CAS Name: 7-hydroxy-8-[(1S,2R)-1,2,3-trihydroxy-3-methylbutyl]-1-benzopyran-2-one IUPAC Name: 7-hydroxy-8-[(1S,2R)-1,2,3-trihydroxy-3-methylbutyl]chromen-2-one Traditional Name: 7-hydroxy-8-[(1S,2R)-1,2,3-trihydroxy-3-methyl-butyl]coumarin Formula: C14H16O6 MolecularWeight: 280.27324

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(C(C1=C(C=CC2=C1OC(=O)C=C2)O)O)O)O

Isomeric SMILES

CC(C)([C@@H]([C@H](C1=C(C=CC2=C1OC(=O)C=C2)O)O)O)O

InChI

InChI=1S/C14H16O6/c1-14(2,19)13(18)11(17)10-8(15)5-3-7-4-6-9(16)20-12(7)10/h3-6,11,13,15,17-19H,1-2H3/t11-,13+/m0/s1