(Q105006863)

English

(2S)-2-[(2R)-2-hydroxy-1-[(2R)-4-(hydroxymethyl)-5-oxo-2H-furan-2-yl]propan-2-yl]-2,3-dihydropyrano[3,2-h][1,4]benzodioxin-9-one

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

5-(2-hydroxy-2-{9-oxo-2H,3H-[1,4]dioxino[2,3-h]chromen-2-yl}propyl)-3-(hydroxymethyl)-5H-furan-2-one

1 reference

based on heuristic

inferred from SMILES

mass

374.100167536 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(2R)-2-[(2R)-2-hydroxy-1-[(2R)-4-(hydroxymethyl)-5-oxo-2H-furan-2-yl]propan-2-yl]-2,3-dihydropyrano[3,2-h][1,4]benzodioxin-9-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₉H₁₈O₈

0 references

canonical SMILES

O=C1OC=2C=3OC(COC3C=CC2C=C1)C(O)(C)CC4OC(=O)C(=C4)CO

0 references

isomeric SMILES

C[C@@](O)(C[C@@H]1C=C(CO)C(=O)O1)[C@@H]1COc2ccc3ccc(=O)oc3c2O1

0 references

found in taxon

Clausena excavata

2 references

stated in

Chemical Constituents ofClausena excavata: Isolation and Structure Elucidation of Novel Furanone-Coumarins with Inhibitory Effects for Tumor-Promotion1

stated in

Chemical constituents of Clausena excavata: isolation and structure elucidation of novel furanone-coumarins with inhibitory effects for tumor-promotion

Identifiers

InChI

InChI=1S/C19H18O8/c1-19(23,7-12-6-11(8-20)18(22)25-12)14-9-24-13-4-2-10-3-5-15(21)27-16(10)17(13)26-14/h2-6,12,14,20,23H,7-9H2,1H3/t12-,14-,19+/m0/s1

0 references

InChIKey

GDPHCYVELMTBIG-PTAUBWNISA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

GDPHCYVELMTBIG-PTAUBWNISA-N

(Q105006863)

(2S)-2-[(2R)-2-hydroxy-1-[(2R)-4-(hydroxymethyl)-5-oxo-2H-furan-2-yl]propan-2-yl]-2,3-dihydropyrano[3,2-h][1,4]benzodioxin-9-one

Statements

Identifiers

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