(Q105113223)

English

5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-6-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-8-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]chromen-4-one

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

5-Hydroxy-2-(4-hydroxyphenyl)-7-methoxy-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-8-(3,4,5-trihydroxyoxan-2-yl)chromen-4-one

1 reference

based on heuristic

inferred from SMILES

mass

578.16355564 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₇H₃₀O₁₄

0 references

canonical SMILES

O=C1C=C(OC2=C1C(O)=C(C(OC)=C2C3OCC(O)C(O)C3O)C4OC(CO)C(O)C(O)C4O)C=5C=CC(O)=CC5

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isomeric SMILES

COc1c([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c2c(=O)cc(-c3ccc(O)cc3)oc2c1[C@@H]1OC[C@H](O)[C@H](O)[C@H]1O

0 references

found in taxon

Conchocarpus guyanensis

1 reference

stated in

Flavone C-Glycosides of Almeidea guyanensis

Identifiers

InChI

InChI=1S/C27H30O14/c1-38-24-16(27-23(37)21(35)19(33)14(7-28)41-27)20(34)15-11(30)6-13(9-2-4-10(29)5-3-9)40-25(15)17(24)26-22(36)18(32)12(31)8-39-26/h2-6,12,14,18-19,21-23,26-29,31-37H,7-8H2,1H3/t12-,14+,18-,19+,21-,22+,23+,26-,27-/m0/s1

0 references

InChIKey

IHRVJPZYTSPICL-QHTAQJPCSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

IHRVJPZYTSPICL-QHTAQJPCSA-N

1 reference

http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download

retrieved

15 January 2022

InChIKey

IHRVJPZYTSPICL-QHTAQJPCSA-N

(Q105113223)

5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-6-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-8-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]chromen-4-one

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Identifiers

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