(Q105015238)

English

6-acetyl-5-hydroxy-7-methyl-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxynaphthalene-2-carboxylic acid

chemical compound

In more languages

Statements

type of chemical entity

0 references

6-acetyl-5-hydroxy-7-methyl-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}naphthalene-2-carboxylic acid

1 reference

based on heuristic

inferred from SMILES

422.121296904 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₂₂O₁₀

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canonical SMILES

O=C(O)C1=CC(OC2OC(CO)C(O)C(O)C2O)=C3C(O)=C(C(=O)C)C(=CC3=C1)C

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isomeric SMILES

CC(=O)c1c(C)cc2cc(C(=O)O)cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2c1O

0 references

1 reference

Hastatusides A and B: Two New Phenolic Glucosides fromRumex hastatus

Rumex patientia

1 reference

Five naphthalene glycosides from the roots of Rumex patientia

Identifiers

InChI=1S/C20H22O10/c1-7-3-9-4-10(19(27)28)5-11(14(9)16(24)13(7)8(2)22)29-20-18(26)17(25)15(23)12(6-21)30-20/h3-5,12,15,17-18,20-21,23-26H,6H2,1-2H3,(H,27,28)/t12-,15-,17+,18-,20-/m1/s1

0 references

GPYNRGVKMWCYIE-DIKOWXHZSA-N

0 references

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

UniChem compound ID

1 reference

NMRShiftDB structure ID

1 reference

matched by identifier from

GPYNRGVKMWCYIE-DIKOWXHZSA-N

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