(Q105384788)

English

(3S,4R,5R)-2-[5,7-dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)chromenylium-3-yl]oxyoxane-3,4,5-triol

group of stereoisomers with the chemical formula C₂₂H₂₃O₁₁⁺

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Statements

instance of

group of stereoisomers

0 references

1 reference

463.12348797609 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₂H₂₃O₁₁⁺

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

OC=1C=C(O)C=2C=C(OC3OCC(O)C(O)C3O)C(=[O+]C2C1)C=4C=C(OC)C(O)=C(OC)C4

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isomeric SMILES

COc1cc(-c2[o+]c3cc(O)cc(O)c3cc2OC2OC[C@@H](O)[C@@H](O)[C@@H]2O)cc(OC)c1O

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found in taxon

Lagerstroemia indica

1 reference

stated in

Anthocyanins of Lagerstroemia indica flowers

Identifiers

InChI

InChI=1S/C22H22O11/c1-29-15-3-9(4-16(30-2)19(15)27)21-17(33-22-20(28)18(26)13(25)8-31-22)7-11-12(24)5-10(23)6-14(11)32-21/h3-7,13,18,20,22,25-26,28H,8H2,1-2H3,(H2-,23,24,27)/p+1/t13-,18-,20+,22?/m1/s1

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InChIKey

ZWAAFZOEMBEAAF-XDPSYNDUSA-O

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

ZWAAFZOEMBEAAF-XDPSYNDUSA-O

1 reference

(Q105384788)

(3S,4R,5R)-2-[5,7-dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)chromenylium-3-yl]oxyoxane-3,4,5-triol

Statements

Identifiers

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