(Q105209971)

English

7-[(2S,3R,4S,5S,6R)-6-[[(2R,3S,4S)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-3-(4-methoxyphenyl)chromen-4-one

chemical compound

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instance of

type of chemical entity

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subclass of

7-[6-[[3,4-Dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-3-(4-methoxyphenyl)chromen-4-one

1 reference

based on heuristic

inferred from SMILES

mass

562.16864102 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

7-[(2S,3R,4S,5R,6R)-6-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-3-(4-methoxyphenyl)chromen-4-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

4'-Methoxy-7-[6-O-D-apio-beta-D-furanosyl-beta-D-glucopyranosyloxy]isoflavone

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₇H₃₀O₁₃

0 references

canonical SMILES

O=C1C(=COC2=CC(OC3OC(COC4OCC(O)(CO)C4O)C(O)C(O)C3O)=CC=C12)C=5C=CC(OC)=CC5

0 references

isomeric SMILES

COc1ccc(-c2coc3cc(O[C@@H]4O[C@H](CO[C@@H]5OC[C@@](O)(CO)[C@@H]5O)[C@@H](O)[C@H](O)[C@H]4O)ccc3c2=O)cc1

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found in taxon

Cyclopia intermedia

1 reference

stated in

Polyphenols from Honeybush tea (Cyclopia intermedia).

Identifiers

InChI

InChI=1S/C27H30O13/c1-35-14-4-2-13(3-5-14)17-9-36-18-8-15(6-7-16(18)20(17)29)39-25-23(32)22(31)21(30)19(40-25)10-37-26-24(33)27(34,11-28)12-38-26/h2-9,19,21-26,28,30-34H,10-12H2,1H3/t19-,21-,22+,23-,24-,25-,26-,27+/m1/s1

0 references

InChIKey

PJHJORWYAZKNAL-YPHRCLHISA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

(Q105209971)

7-[(2S,3R,4S,5S,6R)-6-[[(2R,3S,4S)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-3-(4-methoxyphenyl)chromen-4-one

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