(Q27103538)

Quercetin 3,4',7-trissulfate (English)

5 October 2016

chemical formula

C₁₅H₁₀O₁₆S₃

1 reference

Quercetin 3,4',7-trissulfate (English)

5 October 2016

canonical SMILES

C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)OS(=O)(=O)O)O)OS(=O)(=O)O)O)OS(=O)(=O)O

1 reference

Flavonoids of iphiona scabra

Quercetin 3,4',7-trissulfate (English)

5 October 2016

2 references

Flavonoids of iphiona scabra

Flaveria bidentis

1 reference

Quercetin and patuletin 33′-disulphates from flaveria chloraefolia

Identifiers

InChI

InChI=1S/C15H10O16S3/c16-8-3-6(1-2-10(8)30-33(22,23)24)14-15(31-34(25,26)27)13(18)12-9(17)4-7(5-11(12)28-14)29-32(19,20)21/h1-5,16-17H,(H,19,20,21)(H,22,23,24)(H,25,26,27)

1 reference

Quercetin 3,4',7-trissulfate (English)

OHGDJKUWKHBWFH-UHFFFAOYSA-N

5 October 2016

InChIKey

2 references

Quercetin 3,4',7-trissulfate (English)

5 October 2016

ChEBI release 2020-09-01

1 reference

5-Hydroxy-2-[3-hydroxy-4-(sulfooxy)phenyl]-4-oxo-4H-chromene-3,7-diyl bis(hydrogen sulfate) (English)

5 October 2016

2 references

Quercetin 3,4',7-trissulfate (English)

matched by identifier from

5 October 2016

InChIKey

OHGDJKUWKHBWFH-UHFFFAOYSA-N

Reaxys registry number

6761534

1 reference

quercetin 3,4',7-trissulfate (English)

5 October 2016

ChEBI ID

28167

mapping relation type

3 references

quercetin 3,4',7-trissulfate (English)

5 October 2016

matched by identifier from

ChEBI release 2019-10-02

International Chemical Identifier

InChI

InChI=1S/C15H10O16S3/c16-8-3-6(1-2-10(8)30-33(22,23)24)14-15(31-34(25,26)27)13(18)12-9(17)4-7(5-11(12)28-14)29-32(19,20)21/h1-5,16-17H,(H,19,20,21)(H,22,23,24)(H,25,26,27)

1 reference

3 references

quercetin 3,4',7-trissulfate (English)

matched by identifier from

5 October 2016

based on heuristic

inferred from InChIKey

InChIKey

OHGDJKUWKHBWFH-UHFFFAOYSA-N

0 references

1 reference

http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download