2,5,7-trimethoxy-1,3,6-tris(oxidanyl)xanthen-9-one

Systemtic Name: 2,5,7-trimethoxy-1,3,6-tris(oxidanyl)xanthen-9-one Openeye Name: 1,3,6-trihydroxy-2,5,7-trimethoxy-xanthen-9-one CAS Name: 1,3,6-trihydroxy-2,5,7-trimethoxy-9-xanthenone IUPAC Name: 1,3,6-trihydroxy-2,5,7-trimethoxyxanthen-9-one Traditional Name: 1,3,6-trihydroxy-2,5,7-trimethoxy-xanthone Formula: C16H14O8 MolecularWeight: 334.27756

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C2C(=C1)C(=O)C3=C(C(=C(C=C3O2)O)OC)O)OC)O

Isomeric SMILES

COC1=C(C(=C2C(=C1)C(=O)C3=C(C(=C(C=C3O2)O)OC)O)OC)O

InChI

InChI=1S/C16H14O8/c1-21-9-4-6-11(18)10-8(5-7(17)15(22-2)13(10)20)24-14(6)16(23-3)12(9)19/h4-5,17,19-20H,1-3H3