(Q105142850)

English

9-methoxy-7-[3-methoxy-4-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-[1,3]dioxolo[4,5-g]chromen-8-one

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

9-Methoxy-7-[3-methoxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-[1,3]dioxolo[4,5-g]chromen-8-one

1 reference

based on heuristic

inferred from SMILES

mass

504.126776208 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

3',5-Dimethoxy-4'-(beta-D-glucopyranosyloxy)-6,7-(methylenedioxy)isoflavone

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₄H₂₄O₁₂

0 references

canonical SMILES

O=C1C(=COC=2C=C3OCOC3=C(OC)C12)C=4C=CC(OC5OC(CO)C(O)C(O)C5O)=C(OC)C4

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isomeric SMILES

COc1cc(-c2coc3cc4c(c(OC)c3c2=O)OCO4)ccc1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O

0 references

found in taxon

Iris x germanica

1 reference

stated in

Isoflavonoid glycosides from the rhizomes of Iris germanica.

Identifiers

InChI

InChI=1S/C24H24O12/c1-30-13-5-10(3-4-12(13)35-24-21(29)20(28)19(27)16(7-25)36-24)11-8-32-14-6-15-22(34-9-33-15)23(31-2)17(14)18(11)26/h3-6,8,16,19-21,24-25,27-29H,7,9H2,1-2H3/t16-,19-,20+,21+,24-/m1/s1

0 references

InChIKey

KLWNTVOUNRWTLN-NTLUWEIDSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

KLWNTVOUNRWTLN-NTLUWEIDSA-N

(Q105142850)

9-methoxy-7-[3-methoxy-4-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-[1,3]dioxolo[4,5-g]chromen-8-one

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