(Q115946744)

English

[5,7-dihydroxy-2-[3,4,6-trihydroxy-5-oxo-1-(3,5,7-trihydroxy-3,4-dihydro-2H-chromen-2-yl)benzo[7]annulen-7-yl]-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate

group of stereoisomers with the chemical formula C₃₆H₂₈O₁₆

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Statements

instance of

group of stereoisomers

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subclass of

chemical compound

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mass

716.137734816 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₆H₂₈O₁₆

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canonical SMILES

O=C(OC1CC=2C(O)=CC(O)=CC2OC1C=3C=CC=4C(C(=O)C3O)=C(O)C(O)=CC4C5OC=6C=C(O)C=C(O)C6CC5O)C7=CC(O)=C(O)C(O)=C7

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found in taxon

Camellia sinensis

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stated in

Identifiers

InChI

InChI=1S/C36H28O16/c37-13-5-20(39)18-10-25(44)34(50-26(18)7-13)17-9-24(43)32(47)29-15(17)1-2-16(30(45)33(29)48)35-28(11-19-21(40)6-14(38)8-27(19)51-35)52-36(49)12-3-22(41)31(46)23(42)4-12/h1-9,25,28,34-35,37-44,46-47H,10-11H2,(H,45,48)

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InChIKey

LYDDTLMHZWWJST-UHFFFAOYSA-N

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2 references

2 January 2023

inferred from InChIKey

matched by identifier from

InChIKey

LYDDTLMHZWWJST-UHFFFAOYSA-N

KNApSAcK ID

C00059535

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

LYDDTLMHZWWJST-UHFFFAOYSA-N

(Q115946744)

[5,7-dihydroxy-2-[3,4,6-trihydroxy-5-oxo-1-(3,5,7-trihydroxy-3,4-dihydro-2H-chromen-2-yl)benzo[7]annulen-7-yl]-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate

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Identifiers

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