(Q104996633)

English

5-hydroxy-2-(4-hydroxyphenyl)-7-[(2S,4S,5S)-3,4,5-trihydroxy-6-[[(2R,3S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one

group of stereoisomers with the chemical formula C₂₇H₃₀O₁₄

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instance of

group of stereoisomers

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subclass of

5-hydroxy-2-(4-hydroxyphenyl)-7-[(2S,5S)-3,4,5-trihydroxy-6-[[(2R,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one

1 reference

based on heuristic

inferred from SMILES

mass

578.1635556399999 dalton

1 reference

based on heuristic

inferred from isomeric SMILES

chemical formula

C₂₇H₃₀O₁₄

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canonical SMILES

O=C1C=C(OC2=CC(OC3OC(COC4OC(C)C(O)C(O)C4O)C(O)C(O)C3O)=CC(O)=C12)C=5C=CC(O)=CC5

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isomeric SMILES

CC1O[C@@H](OCC2O[C@@H](Oc3cc(O)c4c(=O)cc(-c5ccc(O)cc5)oc4c3)C(O)[C@@H](O)[C@@H]2O)[C@@H](O)C(O)[C@H]1O

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Identifiers

InChI

InChI=1S/C27H30O14/c1-10-20(31)22(33)24(35)26(38-10)37-9-18-21(32)23(34)25(36)27(41-18)39-13-6-14(29)19-15(30)8-16(40-17(19)7-13)11-2-4-12(28)5-3-11/h2-8,10,18,20-29,31-36H,9H2,1H3/t10?,18?,20-,21+,22?,23-,24-,25?,26+,27+/m0/s1

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InChIKey

FKIYLTVJPDLUDL-XBIXBMOKSA-N

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PubChem CID

162952229

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

FKIYLTVJPDLUDL-XBIXBMOKSA-N

(Q104996633)

5-hydroxy-2-(4-hydroxyphenyl)-7-[(2S,4S,5S)-3,4,5-trihydroxy-6-[[(2R,3S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one

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