(3S)-6-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-3-[2-(4-methoxyphenyl)ethyl]-8-oxidanyl-3,4-dihydroisochromen-1-one

Systemtic Name: (3S)-6-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-3-[2-(4-methoxyphenyl)ethyl]-8-oxidanyl-3,4-dihydroisochromen-1-one Openeye Name: (3S)-8-hydroxy-3-[2-(4-methoxyphenyl)ethyl]-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-isochroman-1-one CAS Name: (3S)-8-hydroxy-3-[2-(4-methoxyphenyl)ethyl]-6-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-3,4-dihydro-1H-2-benzopyran-1-one IUPAC Name: (3S)-8-hydroxy-3-[2-(4-methoxyphenyl)ethyl]-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydroisochromen-1-one Traditional Name: (3S)-8-hydroxy-3-[2-(4-methoxyphenyl)ethyl]-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxy-isochroman-1-one Formula: C24H28O10 MolecularWeight: 476.47312

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCC2CC3=CC(=CC(=C3C(=O)O2)O)OC4C(C(C(C(O4)CO)O)O)O

Isomeric SMILES

COC1=CC=C(C=C1)CC[C@H]2CC3=CC(=CC(=C3C(=O)O2)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O

InChI

InChI=1S/C24H28O10/c1-31-14-5-2-12(3-6-14)4-7-15-8-13-9-16(10-17(26)19(13)23(30)32-15)33-24-22(29)21(28)20(27)18(11-25)34-24/h2-3,5-6,9-10,15,18,20-22,24-29H,4,7-8,11H2,1H3/t15-,18+,20+,21-,22+,24+/m0/s1