(Q105346685)

English

(2S,3S)-2,3-bis[3-(3,4-dihydroxyphenyl)prop-2-enoyloxy]butanedioic acid

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

Cichoric acid;Dicaffeoyltartaric acid

1 reference

based on heuristic

inferred from SMILES

mass

474.079826016 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(2S,3S)-2,3-bis[[(Z)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]butanedioic acid

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(2R,3R)-2,3-bis[[(Z)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]butanedioic acid

1 reference

1 reference

1 reference

C₂₂H₁₈O₁₂

0 references

canonical SMILES

O=C(OC(C(=O)O)C(OC(=O)C=CC1=CC=C(O)C(O)=C1)C(=O)O)C=CC2=CC=C(O)C(O)=C2

0 references

isomeric SMILES

O=C(C=Cc1ccc(O)c(O)c1)O[C@H](C(=O)O)[C@H](OC(=O)C=Cc1ccc(O)c(O)c1)C(=O)O

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found in taxon

Youngia japonica

1 reference

stated in

Studies on the constituents of whole plants of Youngia japonica.

Identifiers

InChI

InChI=1S/C22H18O12/c23-13-5-1-11(9-15(13)25)3-7-17(27)33-19(21(29)30)20(22(31)32)34-18(28)8-4-12-2-6-14(24)16(26)10-12/h1-10,19-20,23-26H,(H,29,30)(H,31,32)/t19-,20-/m0/s1

0 references

InChIKey

YDDGKXBLOXEEMN-PMACEKPBSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

YDDGKXBLOXEEMN-PMACEKPBSA-N

1 reference

(Q105346685)

(2S,3S)-2,3-bis[3-(3,4-dihydroxyphenyl)prop-2-enoyloxy]butanedioic acid

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Identifiers

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