(Q105298013)

English

[6-(7-{[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}-5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-8-yl)-3,4,5-trihydroxyoxan-2-yl]methyl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

group of stereoisomers with the chemical formula C₄₂H₄₆O₂₂

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Statements

instance of

group of stereoisomers

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subclass of

6C-glycosylated flavone

1 reference

inferred from

6C-glycosylated flavone

6,8C-substituted flavone

1 reference

inferred from

6,8C-substituted flavone

1 reference

902.2480731120007 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₄₂H₄₆O₂₂

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canonical SMILES

O=C(OCC1OC(C=2C=3OC(=CC(=O)C3C(O)=C(C2OC4OCC(O)(CO)C4O)C5OC(CO)C(O)C(O)C5O)C=6C=CC(O)=CC6)C(O)C(O)C1O)C=CC7=CC=C(O)C(OC)=C7

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Identifiers

InChI

InChI=1S/C42H46O22/c1-58-22-10-16(2-8-19(22)46)3-9-25(48)59-13-24-30(50)33(53)35(55)39(63-24)28-36-26(20(47)11-21(61-36)17-4-6-18(45)7-5-17)31(51)27(38-34(54)32(52)29(49)23(12-43)62-38)37(28)64-41-40(56)42(57,14-44)15-60-41/h2-11,23-24,29-30,32-35,38-41,43-46,49-57H,12-15H2,1H3

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InChIKey

VWDHYOBWFQBNEZ-UHFFFAOYSA-N

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PubChem CID

162902356

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

VWDHYOBWFQBNEZ-UHFFFAOYSA-N

(Q105298013)

[6-(7-{[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}-5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-8-yl)-3,4,5-trihydroxyoxan-2-yl]methyl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

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Identifiers

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