2-[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4S,5R)-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]oxymethyl]-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-7-methoxy-1,3,6-tris(oxidanyl)xanthen-9-one

Systemtic Name: 2-[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4S,5R)-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]oxymethyl]-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-7-methoxy-1,3,6-tris(oxidanyl)xanthen-9-one Openeye Name: 2-[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]oxymethyl]-3,4,5-trihydroxy-tetrahydropyran-2-yl]oxy-1,3,6-trihydroxy-7-methoxy-xanthen-9-one CAS Name: 2-[[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]oxymethyl]-3,4,5-trihydroxy-2-oxanyl]oxy]-1,3,6-trihydroxy-7-methoxy-9-xanthenone IUPAC Name: 2-[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-1,3,6-trihydroxy-7-methoxyxanthen-9-one Traditional Name: 2-[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4S,5R)-3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl]oxymethyl]-3,4,5-trihydroxy-tetrahydropyran-2-yl]oxy-1,3,6-trihydroxy-7-methoxy-xanthone Formula: C25H28O16 MolecularWeight: 584.48022

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)C3=C(C(=C(C=C3O2)O)OC4C(C(C(C(O4)COC5C(C(C(O5)CO)O)O)O)O)O)O)O

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)C3=C(C(=C(C=C3O2)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO[C@H]5[C@@H]([C@@H]([C@H](O5)CO)O)O)O)O)O)O)O

InChI

InChI=1S/C25H28O16/c1-36-11-2-7-10(3-8(11)27)38-12-4-9(28)23(19(32)15(12)16(7)29)41-25-22(35)20(33)18(31)14(40-25)6-37-24-21(34)17(30)13(5-26)39-24/h2-4,13-14,17-18,20-22,24-28,30-35H,5-6H2,1H3/t13-,14-,17-,18-,20+,21-,22-,24-,25+/m1/s1