(Q105142348)

English

(1S,2S,3R)-2,3,7-trihydroxy-3-(hydroxymethyl)-6-methoxy-1-(3,4,5-trihydroxyphenyl)-1,4-dihydronaphthalene-2-carboxylic acid

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

2,3,7-Trihydroxy-3-(hydroxymethyl)-6-methoxy-1-(3,4,5-trihydroxyphenyl)-1,4-dihydronaphthalene-2-carboxylic acid

1 reference

based on heuristic

inferred from SMILES

mass

408.10564684 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₉H₂₀O₁₀

0 references

canonical SMILES

O=C(O)C1(O)C(C2=CC(O)=C(O)C(O)=C2)C3=CC(O)=C(OC)C=C3CC1(O)CO

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isomeric SMILES

COc1cc2c(cc1O)[C@H](c1cc(O)c(O)c(O)c1)[C@@](O)(C(=O)O)[C@](O)(CO)C2

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found in taxon

Thuja plicata

1 reference

stated in

The lignans of thuja plicata and the sapwood-heartwood transformation

Identifiers

InChI

InChI=1S/C19H20O10/c1-29-14-4-9-6-18(27,7-20)19(28,17(25)26)15(10(9)5-11(14)21)8-2-12(22)16(24)13(23)3-8/h2-5,15,20-24,27-28H,6-7H2,1H3,(H,25,26)/t15-,18+,19+/m0/s1

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InChIKey

KKSUHBFLIMHHTI-KFKAGJAMSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

KKSUHBFLIMHHTI-KFKAGJAMSA-N

(Q105142348)

(1S,2S,3R)-2,3,7-trihydroxy-3-(hydroxymethyl)-6-methoxy-1-(3,4,5-trihydroxyphenyl)-1,4-dihydronaphthalene-2-carboxylic acid

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Identifiers

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