(Q105275612)

English

3-[(2S,3S,4R,5R,6S)-4,5-dihydroxy-6-methyl-3-[(2S,3S,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)chromen-4-one

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

3-[4,5-Dihydroxy-6-methyl-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)chromen-4-one

1 reference

based on heuristic

inferred from SMILES

mass

610.15338488 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

3-[(2-O-alpha-L-Rhamnopyranosyl-alpha-L-rhamnopyranosyl)oxy]-3',4',5,5',7-pentahydroxyflavone

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₇H₃₀O₁₆

0 references

canonical SMILES

O=C1C(OC2OC(C)C(O)C(O)C2OC3OC(C)C(O)C(O)C3O)=C(OC=4C=C(O)C=C(O)C14)C=5C=C(O)C(O)=C(O)C5

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isomeric SMILES

C[C@@H]1O[C@@H](O[C@@H]2[C@H](Oc3c(-c4cc(O)c(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)O[C@@H](C)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O

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found in taxon

Licania densiflora

1 reference

stated in

Three flavonoids from Licania densiflora

Identifiers

InChI

InChI=1S/C27H30O16/c1-7-16(32)20(36)22(38)26(39-7)43-25-21(37)17(33)8(2)40-27(25)42-24-19(35)15-11(29)5-10(28)6-14(15)41-23(24)9-3-12(30)18(34)13(31)4-9/h3-8,16-17,20-22,25-34,36-38H,1-2H3/t7-,8-,16-,17-,20+,21+,22-,25-,26-,27-/m0/s1

0 references

InChIKey

UMLQYKKIQCBBDM-QMZAOPQFSA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

(Q105275612)

3-[(2S,3S,4R,5R,6S)-4,5-dihydroxy-6-methyl-3-[(2S,3S,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)chromen-4-one

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