4,8-bis(oxidanyl)spiro[5a,6a,12,12a,13a,14-hexahydrochromeno[3,2-b]xanthene-6,1'-cycloheptane]-13-one

Systemtic Name: 4,8-bis(oxidanyl)spiro[5a,6a,12,12a,13a,14-hexahydrochromeno[3,2-b]xanthene-6,1'-cycloheptane]-13-one Openeye Name: 4,8-dihydroxyspiro[5a,6a,12,12a,13a,14-hexahydrochromeno[3,2-b]xanthene-6,1'-cycloheptane]-13-one CAS Name: 4,8-dihydroxy-13-spiro[5a,6a,12,12a,13a,14-hexahydro[1]benzopyrano[3,2-b]xanthene-6,1'-cycloheptane]one IUPAC Name: 4,8-dihydroxyspiro[5a,6a,12,12a,13a,14-hexahydrochromeno[3,2-b]xanthene-6,1'-cycloheptane]-13-one Traditional Name: 4,8-dihydroxyspiro[5a,6a,12,12a,13a,14-hexahydrochromeno[3,2-b]xanthene-6,1'-cycloheptane]-13-one Formula: C26H28O5 MolecularWeight: 420.49752

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC2(CC1)C3C(CC4=C(O3)C(=CC=C4)O)C(=O)C5C2OC6=C(C5)C=CC=C6O

Isomeric SMILES

C1CCCC2(CC1)C3C(CC4=C(O3)C(=CC=C4)O)C(=O)C5C2OC6=C(C5)C=CC=C6O

InChI

InChI=1S/C26H28O5/c27-19-9-5-7-15-13-17-21(29)18-14-16-8-6-10-20(28)23(16)31-25(18)26(24(17)30-22(15)19)11-3-1-2-4-12-26/h5-10,17-18,24-25,27-28H,1-4,11-14H2