(2R)-2-[3-[(2R,3R)-3-[(1R)-1-carboxy-2-(3,4-dihydroxyphenyl)ethoxy]carbonyl-2-(3,4-dihydroxyphenyl)-7-hydroxy-2,3-dihydro-1-benzofuran-4-yl]prop-2-enoyloxy]-3-(3,4-dihydroxyphenyl)propanoic acid (Q104250809)

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chemical compound

Language	Label	Description	Also known as
English	(2R)-2-[3-[(2R,3R)-3-[(1R)-1-carboxy-2-(3,4-dihydroxyphenyl)ethoxy]carbonyl-2-(3,4-dihydroxyphenyl)-7-hydroxy-2,3-dihydro-1-benzofuran-4-yl]prop-2-enoyloxy]-3-(3,4-dihydroxyphenyl)propanoic acid	chemical compound

Statements

type of chemical entity

0 references

Salvianic acid B

1 reference

based on heuristic

inferred from SMILES

(2R)-2-({(2E)-3-[(2R,3R)-3-{[1-carboxy-2-(3,4-dihydroxyphenyl)ethoxy]carbonyl}-2-(3,4-dihydroxyphenyl)-7-hydroxy-2,3-dihydro-1-benzofuran-4-yl]prop-2-enoyl}oxy)-3-(3,4-dihydroxyphenyl)propanoic acid

1 reference

based on heuristic

inferred from SMILES

718.15338488 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(2S)-2-{[(2E)-3-[(2S,3S)-3-{[(1S)-1-carboxy-2-(3,4-dihydroxyphenyl)ethoxy]carbonyl}-2-(3,4-dihydroxyphenyl)-7-hydroxy-2,3-dihydro-1-benzofuran-4-yl]prop-2-enoyl]oxy}-3-(3,4-dihydroxyphenyl)propanoic acid

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(2R)-2-{[(2E)-3-[(2R,3R)-3-{[(1R)-1-carboxy-2-(3,4-dihydroxyphenyl)ethoxy]carbonyl}-2-(3,4-dihydroxyphenyl)-7-hydroxy-2,3-dihydro-1-benzofuran-4-yl]prop-2-enoyl]oxy}-3-(3,4-dihydroxyphenyl)propanoic acid

1 reference

based on heuristic

inferred from InChIKey

salvianolic acid B

1 reference

based on heuristic

inferred from InChI

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₆H₃₀O₁₆

0 references

canonical SMILES

O=C(OC(C(=O)O)CC1=CC=C(O)C(O)=C1)C=CC2=CC=C(O)C=3OC(C4=CC=C(O)C(O)=C4)C(C(=O)OC(C(=O)O)CC5=CC=C(O)C(O)=C5)C23

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isomeric SMILES

O=C(C=Cc1ccc(O)c2c1[C@@H](C(=O)O[C@H](Cc1ccc(O)c(O)c1)C(=O)O)[C@H](c1ccc(O)c(O)c1)O2)O[C@H](Cc1ccc(O)c(O)c1)C(=O)O

0 references

Salvia miltiorrhiza

5 references

Antidiabetic potential of salvianolic acid B in multiple low-dose streptozotocin-induced diabetes

Protection of PC12 cells from hydrogen peroxide-induced cytotoxicity by salvianolic acid B, a new compound isolated from Radix Salviae miltiorrhizae

Preparative isolation and purification of salvianolic acid B from the Chinese medicinal plant Salvia miltiorrhiza by high-speed counter-current chromatography

Stereostructure of Salvianolic Acid B and Isolation of Salvianolic Acid C from Salvia miltiorrhiza

Simultaneous detection of seven phenolic acids in Danshen injection using HPLC with ultraviolet detector

Salvia cavaleriei

1 reference

Salvianolic Acid I: A New Depside from Salvia cavaleriei

Salvia chinensis

1 reference

Isosalvianolic acid C, a depside possessing a dibenzooxepin skeleton

1 reference

Salvianolic acid J, a depside from Salvia flava

Identifiers

InChI=1S/C36H30O16/c37-20-6-1-16(11-24(20)41)13-27(34(45)46)50-29(44)10-5-18-3-9-23(40)33-30(18)31(32(52-33)19-4-8-22(39)26(43)15-19)36(49)51-28(35(47)48)14-17-2-7-21(38)25(42)12-17/h1-12,15,27-28,31-32,37-43H,13-14H2,(H,45,46)(H,47,48)/t27-,28-,31-,32+/m1/s1

0 references

SNKFFCBZYFGCQN-HIIQBPBGSA-N

0 references

2 references

17 September 2022

based on heuristic

inferred from InChIKey

matched by identifier from

SNKFFCBZYFGCQN-HIIQBPBGSA-N

UniChem compound ID

1 reference

Sitelinks

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Multilingual sites(0 entries)

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