(Q104995122)

English

methyl (2S,3S,4S,5R,6S)-6-[2-(3,4-dihydroxyphenyl)-7-hydroxy-4-oxochromen-5-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

Methyl 6-[2-(3,4-dihydroxyphenyl)-7-hydroxy-4-oxochromen-5-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylate

1 reference

based on heuristic

inferred from SMILES

mass

476.09547608 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₂H₂₀O₁₂

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canonical SMILES

O=C1C=C(OC2=CC(O)=CC(OC3OC(C(=O)OC)C(O)C(O)C3O)=C12)C=4C=CC(O)=C(O)C4

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isomeric SMILES

COC(=O)[C@H]1O[C@@H](Oc2cc(O)cc3oc(-c4ccc(O)c(O)c4)cc(=O)c23)[C@H](O)[C@@H](O)[C@@H]1O

0 references

found in taxon

Dumortiera hirsuta

1 reference

stated in

Carboxylated α-pyrone derivatives and flavonoids from the liverwort Dumortiera hirsuta

Identifiers

InChI

InChI=1S/C22H20O12/c1-31-21(30)20-18(28)17(27)19(29)22(34-20)33-15-6-9(23)5-14-16(15)12(26)7-13(32-14)8-2-3-10(24)11(25)4-8/h2-7,17-20,22-25,27-29H,1H3/t17-,18-,19+,20-,22+/m0/s1

0 references

InChIKey

FGXKPOIQALKETF-SXFAUFNYSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

FGXKPOIQALKETF-SXFAUFNYSA-N

1 reference

http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download

retrieved

15 January 2022

InChIKey

FGXKPOIQALKETF-SXFAUFNYSA-N

(Q104995122)

methyl (2S,3S,4S,5R,6S)-6-[2-(3,4-dihydroxyphenyl)-7-hydroxy-4-oxochromen-5-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylate

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Identifiers

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