(Q105143591)

English

6,7,14-trihydroxy-13-[(2R,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

6,7,14-Trihydroxy-13-(3,4,5-trihydroxyoxan-2-yl)oxy-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione

1 reference

based on heuristic

inferred from SMILES

mass

434.048525888 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

Ellagic acid arabinoside

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

Ellagic acid 4-O-xylopyranoside

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₉H₁₄O₁₂

0 references

canonical SMILES

O=C1OC=2C(O)=C(OC3OCC(O)C(O)C3O)C=C4C(=O)OC5=C(O)C(O)=CC1=C5C24

0 references

isomeric SMILES

O=c1oc2c(O)c(O[C@H]3OC[C@@H](O)[C@H](O)[C@H]3O)cc3c(=O)oc4c(O)c(O)cc1c4c23

0 references

found in taxon

Rosa laevigata

1 reference

stated in

Protective effects of radix Rosa laevigata against Propionibacterium acnes and lipopolysaccharide-induced liver injury.

Identifiers

InChI

InChI=1S/C19H14O12/c20-6-1-4-9-10-5(18(27)30-15(9)12(6)23)2-8(13(24)16(10)31-17(4)26)29-19-14(25)11(22)7(21)3-28-19/h1-2,7,11,14,19-25H,3H2/t7-,11+,14-,19-/m1/s1

0 references

InChIKey

KNURQRIPZJJYQO-MLMLWEKWSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

KNURQRIPZJJYQO-MLMLWEKWSA-N

(Q105143591)

6,7,14-trihydroxy-13-[(2R,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione

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