(Q105235505)

English

(2S,3S,4R,5R,6S)-2-[5,7-dihydroxy-2-(4-hydroxyphenyl)chromenylium-3-yl]oxy-6-methyloxane-3,4,5-triol

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

flavylium compound

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mass

417.11800867209 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

Pelargonidin 3-rhamnoside

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₁H₂₁O₉⁺

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

OC=1C=CC(=CC1)C2=[O+]C=3C=C(O)C=C(O)C3C=C2OC4OC(C)C(O)C(O)C4O

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isomeric SMILES

C[C@@H]1O[C@@H](Oc2cc3c(O)cc(O)cc3[o+]c2-c2ccc(O)cc2)[C@@H](O)[C@H](O)[C@H]1O

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found in taxon

Millettia zechiana

1 reference

stated in

3-Hydroxy-4′-methoxyflavone from Millettia zechiana

Identifiers

InChI

InChI=1S/C21H20O9/c1-9-17(25)18(26)19(27)21(28-9)30-16-8-13-14(24)6-12(23)7-15(13)29-20(16)10-2-4-11(22)5-3-10/h2-9,17-19,21,25-27H,1H3,(H2-,22,23,24)/p+1/t9-,17-,18+,19-,21-/m0/s1

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InChIKey

RFOBAKWGJRIIMU-TUJYBLGZSA-O

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

RFOBAKWGJRIIMU-TUJYBLGZSA-O

1 reference

(Q105235505)

(2S,3S,4R,5R,6S)-2-[5,7-dihydroxy-2-(4-hydroxyphenyl)chromenylium-3-yl]oxy-6-methyloxane-3,4,5-triol

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Identifiers

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