(Q105110913)

English

[3'-(2-Isopropyl-4-hydroxy-5-methylphenoxy)-4',5-dihydroxyflavone-7-yl]beta-D-glucopyranosiduronic acid

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

3,4,5-Trihydroxy-6-[5-hydroxy-2-[4-hydroxy-3-(4-hydroxy-5-methyl-2-propan-2-ylphenoxy)phenyl]-4-oxochromen-7-yl]oxyoxane-2-carboxylic acid

1 reference

based on heuristic

inferred from SMILES

mass

610.16864102 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₁H₃₀O₁₃

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canonical SMILES

O=C(O)C1OC(OC2=CC(O)=C3C(=O)C=C(OC3=C2)C=4C=CC(O)=C(OC5=CC(=C(O)C=C5C(C)C)C)C4)C(O)C(O)C1O

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isomeric SMILES

Cc1cc(Oc2cc(-c3cc(=O)c4c(O)cc(O[C@@H]5O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]5O)cc4o3)ccc2O)c(C(C)C)cc1O

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found in taxon

Monarda punctata

1 reference

stated in

A lipase inhibitor monoterpene and monoterpene glycosides from Monarda punctata

Identifiers

InChI

InChI=1S/C31H30O13/c1-12(2)16-10-18(33)13(3)6-22(16)43-23-7-14(4-5-17(23)32)21-11-20(35)25-19(34)8-15(9-24(25)42-21)41-31-28(38)26(36)27(37)29(44-31)30(39)40/h4-12,26-29,31-34,36-38H,1-3H3,(H,39,40)/t26-,27-,28+,29-,31+/m0/s1

0 references

InChIKey

ICDSELIXFBKIOM-SQQOACJHSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

ICDSELIXFBKIOM-SQQOACJHSA-N

1 reference

2 references

inferred from InChIKey

matched by identifier from

InChIKey

ICDSELIXFBKIOM-SQQOACJHSA-N

(Q105110913)

[3'-(2-Isopropyl-4-hydroxy-5-methylphenoxy)-4',5-dihydroxyflavone-7-yl]beta-D-glucopyranosiduronic acid

Statements

Identifiers

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