(Q105153036)

English

3-[(2R)-2-(2-hydroxypropan-2-yl)-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydro-1-benzofuran-5-yl]propanoic acid

chemical compound

In more languages

edit

Statements

instance of

type of chemical entity

0 references

subclass of

3-[2-(2-hydroxypropan-2-yl)-4-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,3-dihydro-1-benzofuran-5-yl]propanoic acid

1 reference

based on heuristic

inferred from SMILES

3-[2-(2-Hydroxypropan-2-yl)-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydro-1-benzofuran-5-yl]propanoic acid

1 reference

based on heuristic

inferred from SMILES

mass

428.168247096 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

3-[(2S)-2-(2-hydroxypropan-2-yl)-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydro-1-benzofuran-5-yl]propanoic acid

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

3-[(2R)-2-(2-hydroxypropan-2-yl)-4-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydro-1-benzofuran-5-yl]propanoic acid

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₀H₂₈O₁₀

0 references

canonical SMILES

O=C(O)CCC1=CC=C2OC(CC2=C1OC3OC(CO)C(O)C(O)C3O)C(O)(C)C

0 references

isomeric SMILES

CC(C)(O)[C@H]1Cc2c(ccc(CCC(=O)O)c2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)O1

0 references

found in taxon

Angelica tenuisecta var. furcijuga

1 reference

stated in

Absolute Stereostructures of Acylated Khellactone-Type Coumarins from Angelica furcijuga

Identifiers

InChI

InChI=1S/C20H28O10/c1-20(2,27)13-7-10-11(28-13)5-3-9(4-6-14(22)23)18(10)30-19-17(26)16(25)15(24)12(8-21)29-19/h3,5,12-13,15-17,19,21,24-27H,4,6-8H2,1-2H3,(H,22,23)/t12-,13-,15-,16+,17-,19+/m1/s1

0 references

InChIKey

LKFCTFLKUBJQLA-LDSJTTMQSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

LKFCTFLKUBJQLA-LDSJTTMQSA-N

(Q105153036)

3-[(2R)-2-(2-hydroxypropan-2-yl)-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydro-1-benzofuran-5-yl]propanoic acid

Statements

Identifiers

Sitelinks

Wikipedia(0 entries)

Wikibooks(0 entries)

Wikinews(0 entries)

Wikiquote(0 entries)

Wikisource(0 entries)

Wikiversity(0 entries)

Wikivoyage(0 entries)

Wiktionary(0 entries)

Multilingual sites(0 entries)