(Q111241590)

English

13-(4-Benzoyl-3,5-dihydroxyphenoxy)-3,4,5,14,15,20,21,22-octahydroxy-9,12,17-trioxatetracyclo[17.3.1.02,7.011,16]tricosa-1(23),2,4,6,19,21-hexaene-8,18-dione

group of stereoisomers with the chemical formula C₃₃H₂₆O₁₇

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Statements

instance of

group of stereoisomers

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subclass of

chemical compound

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mass

694.116999372 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₃H₂₆O₁₇

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canonical SMILES

O=C1OCC2OC(OC3=CC(O)=C(C(=O)C=4C=CC=CC4)C(O)=C3)C(O)C(O)C2OC(=O)C5=CC(=C(O)C(O)=C5O)C6=C(O)C(O)=C(O)C=C16

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found in taxon

Psidium guajava

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stated in

Guavins A, C and D, complex tannins from Psidium guajava.

Identifiers

InChI

InChI=1S/C33H26O17/c34-16-6-12(7-17(35)21(16)22(37)11-4-2-1-3-5-11)48-33-29(44)28(43)30-19(49-33)10-47-31(45)14-9-18(36)25(40)26(41)20(14)13-8-15(32(46)50-30)24(39)27(42)23(13)38/h1-9,19,28-30,33-36,38-44H,10H2

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InChIKey

GEQVKVGBCOHKMA-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

GEQVKVGBCOHKMA-UHFFFAOYSA-N

(Q111241590)

13-(4-Benzoyl-3,5-dihydroxyphenoxy)-3,4,5,14,15,20,21,22-octahydroxy-9,12,17-trioxatetracyclo[17.3.1.02,7.011,16]tricosa-1(23),2,4,6,19,21-hexaene-8,18-dione

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Identifiers

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