(Q105264584)

English

5,6-Dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-7-methoxy-4-oxo-4H-1-benzopyran-3-yl beta-D-glucopyranosiduronic acid

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

3,3',5,6-Tetrahydroxy-4',7-dimethoxyflavone 3-glucuronide

1 reference

based on heuristic

inferred from SMILES

mass

522.100955384 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₃H₂₂O₁₄

0 references

canonical SMILES

O=C(O)C1OC(OC=2C(=O)C3=C(O)C(O)=C(OC)C=C3OC2C=4C=CC(OC)=C(O)C4)C(O)C(O)C1O

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isomeric SMILES

COc1ccc(-c2oc3cc(OC)c(O)c(O)c3c(=O)c2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O)cc1O

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found in taxon

Spinacia oleracea

1 reference

stated in

Isolation and characterization of structurally novel antimutagenic flavonoids from spinach (Spinacia oleracea).

Identifiers

InChI

InChI=1S/C23H22O14/c1-33-9-4-3-7(5-8(9)24)19-20(36-23-18(30)16(28)17(29)21(37-23)22(31)32)15(27)12-10(35-19)6-11(34-2)13(25)14(12)26/h3-6,16-18,21,23-26,28-30H,1-2H3,(H,31,32)/t16-,17-,18+,21-,23+/m0/s1

0 references

InChIKey

TTZIHUKKIDPTQT-USFRMQJTSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

TTZIHUKKIDPTQT-USFRMQJTSA-N

1 reference

2 references

inferred from InChIKey

matched by identifier from

InChIKey

TTZIHUKKIDPTQT-USFRMQJTSA-N

(Q105264584)

5,6-Dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-7-methoxy-4-oxo-4H-1-benzopyran-3-yl beta-D-glucopyranosiduronic acid

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Identifiers

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