(Q106010168)

English

5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)chromenium-3-yl 6-O-[(2Z)-3-(4-hydroxyphenyl)prop-2-enoyl]-beta-D-glucopyranoside

chemical compound

In more languages

default for all languages

No label defined

No description defined

edit

Statements

instance of

type of chemical entity

0 references

subclass of

ion

0 references

mass

609.1602674080899 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

peonidin-3-O-(6-O-trans-p-coumaryl-beta-D-glucoside)

1 reference

based on heuristic

inferred from InChI

MFHMTMFSFNMTFQ-YMLRRHDESA-O

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₁H₂₉O₁₃⁺

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

COc1cc(-c2oc3cc(O)cc(=O)c-3cc2OC2OC(C[O+]=C(O)C=Cc3ccc(O)cc3)C(O)C(O)C2O)ccc1O

1 reference

based on heuristic

inferred from isomeric SMILES

isomeric SMILES

COc1cc(-c2oc3cc(O)cc(=O)c-3cc2O[C@@H]2O[C@H](C[O+]=C(O)C=Cc3ccc(O)cc3)[C@@H](O)[C@H](O)[C@H]2O)ccc1O

1 reference

based on heuristic

inferred from InChI

Identifiers

InChI

InChI=1S/C31H28O13/c1-40-23-10-16(5-8-20(23)34)30-24(13-19-21(35)11-18(33)12-22(19)42-30)43-31-29(39)28(38)27(37)25(44-31)14-41-26(36)9-4-15-2-6-17(32)7-3-15/h2-13,25,27-29,31,37-39H,14H2,1H3,(H3-,32,33,34,35,36)/p+1/t25-,27-,28+,29-,31-/m1/s1

1 reference

stated in

ChEBI release 2021-03-01

InChIKey

MFHMTMFSFNMTFQ-GVFKUQRYSA-O

1 reference

stated in

ChEBI release 2021-03-01

PubChem CID

72193653

2 references

stated in

ChEBI release 2021-03-01

matched by identifier from

InChIKey

MFHMTMFSFNMTFQ-GVFKUQRYSA-O

72193654

1 reference

matched by identifier from

InChIKey

MFHMTMFSFNMTFQ-GVFKUQRYSA-O

ChEBI ID

75706

mapping relation type

exact match

2 references

stated in

ChEBI release 2021-03-01

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C31H28O13/c1-40-23-10-16(5-8-20(23)34)30-24(13-19-21(35)11-18(33)12-22(19)42-30)43-31-29(39)28(38)27(37)25(44-31)14-41-26(36)9-4-15-2-6-17(32)7-3-15/h2-13,25,27-29,31,37-39H,14H2,1H3,(H3-,32,33,34,35,36)/p+1/t25-,27-,28+,29-,31-/m1/s1

75707

mapping relation type

exact match

1 reference

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C31H28O13/c1-40-23-10-16(5-8-20(23)34)30-24(13-19-21(35)11-18(33)12-22(19)42-30)43-31-29(39)28(38)27(37)25(44-31)14-41-26(36)9-4-15-2-6-17(32)7-3-15/h2-13,25,27-29,31,37-39H,14H2,1H3,(H3-,32,33,34,35,36)/p+1/t25-,27-,28+,29-,31-/m1/s1

(Q106010168)

5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)chromenium-3-yl 6-O-[(2Z)-3-(4-hydroxyphenyl)prop-2-enoyl]-beta-D-glucopyranoside

Statements

Identifiers

Sitelinks

Wikipedia(0 entries)

Wikibooks(0 entries)

Wikinews(0 entries)

Wikiquote(0 entries)

Wikisource(0 entries)

Wikiversity(0 entries)

Wikivoyage(0 entries)

Wiktionary(0 entries)

Multilingual sites(0 entries)