(Q105218480)

English

3,4,5-Trihydroxy-2-[(7,13,14-trihydroxy-3,10-dioxo-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4,6,8(16),11,13-hexaen-6-yl)oxymethyl]benzoic acid

chemical compound

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instance of

type of chemical entity

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subclass of

chemical compound

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mass

484.027790444 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₂H₁₂O₁₃

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canonical SMILES

O=C(O)C1=CC(O)=C(O)C(O)=C1COC=2C=C3C(=O)OC4=C(O)C(O)=CC=5C(=O)OC(C2O)=C3C45

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found in taxon

Quercus coccifera

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stated in

Dimeric and trimeric hydrolyzable tannins from Quercus coccifera and Quercus suber

Identifiers

InChI

InChI=1S/C22H12O13/c23-9-1-5(20(29)30)8(14(25)15(9)26)4-33-11-3-7-13-12-6(21(31)35-19(13)17(11)28)2-10(24)16(27)18(12)34-22(7)32/h1-3,23-28H,4H2,(H,29,30)

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InChIKey

QCQXPORCTOCKGN-UHFFFAOYSA-N

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1 reference

17 September 2022

inferred from InChIKey

(Q105218480)

3,4,5-Trihydroxy-2-[(7,13,14-trihydroxy-3,10-dioxo-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4,6,8(16),11,13-hexaen-6-yl)oxymethyl]benzoic acid

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Identifiers

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