(Q104974534)

English

sanguisorbic acid dilactone

chemical compound

3,4-dihydroxy-5-({6,7,13,14-tetrahydroxy-3,10-dioxo-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(14),4(16),5,7,11(15),12-hexaen-5-yl}oxy)benzoic acid

In more languages

Statements

type of chemical entity

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chemical compound

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chemical structure

Sanguisorbic acid dilactone.svg
780 × 490; 24 KB

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470.01214038 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₂₁H₁₀O₁₃

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canonical SMILES

O=C(O)C1=CC(O)=C(O)C(OC=2C(O)=C(O)C=3OC(=O)C=4C=C(O)C(O)=C5OC(=O)C2C3C54)=C1

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1 reference

Tannins and Related Polyphenols of Rosaceous Medicinal Plants. XII. Roshenins A-E, Dimeric Hydrolyzable Tannins from Rosa henryi Boul.

Sanguisorba officinalis

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Tannins and related compounds. Part 3. A new phenolic acid, sanguisorbic acid dilactone, and three new ellagitannins, sanguiins H-1, H-2, and H-3, from Sanguisorba officinalis

Identifiers

InChI=1S/C21H10O13/c22-6-1-4(19(28)29)2-8(12(6)24)32-18-11-10-9-5(20(30)33-17(10)14(26)15(18)27)3-7(23)13(25)16(9)34-21(11)31/h1-3,22-27H,(H,28,29)

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DBLLWHYTKRSJEV-UHFFFAOYSA-N

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CAS Registry Number

1 reference

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matched by identifier from

DBLLWHYTKRSJEV-UHFFFAOYSA-N

UniChem compound ID

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Human Metabolome Database ID

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

DBLLWHYTKRSJEV-UHFFFAOYSA-N

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

DBLLWHYTKRSJEV-UHFFFAOYSA-N

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