(Q105340413)

English

2-(3,4,5-Trihydroxyphenyl)-3-(3-O-acetyl-alpha-L-rhamnopyranosyloxy)-5,7-dihydroxy-4H-1-benzopyran-4-one

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

[2-[5,7-Dihydroxy-4-oxo-2-(3,4,5-trihydroxyphenyl)chromen-3-yl]oxy-3,5-dihydroxy-6-methyloxan-4-yl] acetate

1 reference

based on heuristic

inferred from SMILES

mass

506.106040764 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₃H₂₂O₁₃

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canonical SMILES

O=C(OC1C(O)C(OC=2C(=O)C=3C(O)=CC(O)=CC3OC2C=4C=C(O)C(O)=C(O)C4)OC(C)C1O)C

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isomeric SMILES

CC(=O)O[C@@H]1[C@@H](O)[C@H](C)O[C@@H](Oc2c(-c3cc(O)c(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@@H]1O

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found in taxon

Nymphaea maculata

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stated in

Antioxidant constituents of Nymphaea caerulea flowers

Nymphaea odorata

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stated in

Antioxidant constituents of Nymphaea caerulea flowers

Nymphaea nouchali var. caerulea

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stated in

Antioxidant constituents of Nymphaea caerulea flowers

Identifiers

InChI

InChI=1S/C23H22O13/c1-7-16(29)21(34-8(2)24)19(32)23(33-7)36-22-18(31)15-11(26)5-10(25)6-14(15)35-20(22)9-3-12(27)17(30)13(28)4-9/h3-7,16,19,21,23,25-30,32H,1-2H3/t7-,16-,19+,21+,23-/m0/s1

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InChIKey

XRDZXAYKMIAQPJ-OZGUOKOUSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

XRDZXAYKMIAQPJ-OZGUOKOUSA-N

1 reference

(Q105340413)

2-(3,4,5-Trihydroxyphenyl)-3-(3-O-acetyl-alpha-L-rhamnopyranosyloxy)-5,7-dihydroxy-4H-1-benzopyran-4-one

Statements

Identifiers

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