7-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-6-methyl-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-4,5-bis(oxidanyl)oxan-2-yl]oxy-2-(4-hydroxyphenyl)-5,7-bis(oxidanyl)-3,4a-dihydro-2H-chromen-4-one

Systemtic Name: 7-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-6-methyl-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-4,5-bis(oxidanyl)oxan-2-yl]oxy-2-(4-hydroxyphenyl)-5,7-bis(oxidanyl)-3,4a-dihydro-2H-chromen-4-one Openeye Name: 7-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-5,7-dihydroxy-2-(4-hydroxyphenyl)-3,4a-dihydro-2H-chromen-4-one CAS Name: 7-[[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-2-oxanyl]oxy]-2-oxanyl]oxy]-5,7-dihydroxy-2-(4-hydroxyphenyl)-3,4a-dihydro-2H-1-benzopyran-4-one IUPAC Name: 7-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5,7-dihydroxy-2-(4-hydroxyphenyl)-3,4a-dihydro-2H-chromen-4-one Traditional Name: 7-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-methylol-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-5,7-dihydroxy-2-(4-hydroxyphenyl)-3,4a-dihydro-2H-chromen-4-one Formula: C27H34O15 MolecularWeight: 598.54986

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(C(O1)OC2C(C(C(OC2OC3(C=C(C4C(=O)CC(OC4=C3)C5=CC=C(C=C5)O)O)O)CO)O)O)O)O)O

Isomeric SMILES

C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H]([C@H](O[C@H]2OC3(C=C(C4C(=O)CC(OC4=C3)C5=CC=C(C=C5)O)O)O)CO)O)O)O)O)O

InChI

InChI=1S/C27H34O15/c1-10-19(32)21(34)23(36)25(38-10)41-24-22(35)20(33)17(9-28)40-26(24)42-27(37)7-14(31)18-13(30)6-15(39-16(18)8-27)11-2-4-12(29)5-3-11/h2-5,7-8,10,15,17-26,28-29,31-37H,6,9H2,1H3/t10-,15?,17+,18?,19-,20+,21+,22-,23+,24+,25-,26-,27?/m0/s1