(Q104966016)

English

2-(4-Hydroxyphenyl)-5-hydroxy-7-[2-O-[5-O-[(E)-3-methoxy-4-hydroxycinnamoyl]-D-apio-beta-D-furanosyl]-beta-D-glucopyranosyloxy]-4H-1-benzopyran-4-one

chemical compound

In more languages

edit

Statements

instance of

type of chemical entity

0 references

subclass of

[5-[4,5-Dihydroxy-2-[5-hydroxy-2-(4-hydroxyphenyl)-4-oxochromen-7-yl]oxy-6-(hydroxymethyl)oxan-3-yl]oxy-3,4-dihydroxyoxolan-3-yl]methyl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

1 reference

based on heuristic

inferred from SMILES

mass

740.195249692 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₆H₃₆O₁₇

0 references

canonical SMILES

O=C(OCC1(O)COC(OC2C(OC3=CC(O)=C4C(=O)C=C(OC4=C3)C=5C=CC(O)=CC5)OC(CO)C(O)C2O)C1O)C=CC6=CC=C(O)C(OC)=C6

0 references

isomeric SMILES

COc1cc(/C=C/C(=O)OC[C@@]2(O)CO[C@@H](O[C@H]3[C@H](Oc4cc(O)c5c(=O)cc(-c6ccc(O)cc6)oc5c4)O[C@H](CO)[C@@H](O)[C@@H]3O)[C@@H]2O)ccc1O

0 references

found in taxon

celery

1 reference

stated in

Triterpenoids and flavonoids from celery (Apium graveolens).

Identifiers

InChI

InChI=1S/C36H36O17/c1-47-25-10-17(2-8-21(25)39)3-9-28(42)48-15-36(46)16-49-35(33(36)45)53-32-31(44)30(43)27(14-37)52-34(32)50-20-11-22(40)29-23(41)13-24(51-26(29)12-20)18-4-6-19(38)7-5-18/h2-13,27,30-35,37-40,43-46H,14-16H2,1H3/b9-3+/t27-,30-,31+,32-,33+,34-,35+,36-/m1/s1

0 references

InChIKey

CNNDXKQLSAQYHQ-DQPLZYKKSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

CNNDXKQLSAQYHQ-DQPLZYKKSA-N

1 reference

(Q104966016)

2-(4-Hydroxyphenyl)-5-hydroxy-7-[2-O-[5-O-[(E)-3-methoxy-4-hydroxycinnamoyl]-D-apio-beta-D-furanosyl]-beta-D-glucopyranosyloxy]-4H-1-benzopyran-4-one

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)