(Q105177642)

English

(3Z)-6-hydroxy-3-[(4-hydroxyphenyl)-methoxymethylidene]-7-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-1-benzofuran-2-one

chemical compound

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instance of

type of chemical entity

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subclass of

6-Hydroxy-3-[(4-hydroxyphenyl)-methoxymethylidene]-7-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-1-benzofuran-2-one

1 reference

based on heuristic

inferred from SMILES

mass

446.121296904 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₂H₂₂O₁₀

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canonical SMILES

O=C1OC=2C(=CC=C(O)C2C3OC(CO)C(O)C(O)C3O)C1=C(OC)C4=CC=C(O)C=C4

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isomeric SMILES

CO/C(=C1\C(=O)Oc2c1ccc(O)c2[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)c1ccc(O)cc1

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found in taxon

Pterocarpus marsupium

1 reference

stated in

Constituents of Pterocarpus marsupium: an ayurvedic crude drug.

Identifiers

InChI

InChI=1S/C22H22O10/c1-30-19(9-2-4-10(24)5-3-9)14-11-6-7-12(25)15(20(11)32-22(14)29)21-18(28)17(27)16(26)13(8-23)31-21/h2-7,13,16-18,21,23-28H,8H2,1H3/b19-14-/t13-,16-,17+,18-,21+/m1/s1

0 references

InChIKey

NDNUHGSNQYVEIK-CJPISYDXSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

NDNUHGSNQYVEIK-CJPISYDXSA-N

(Q105177642)

(3Z)-6-hydroxy-3-[(4-hydroxyphenyl)-methoxymethylidene]-7-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-1-benzofuran-2-one

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