(Q104946464)

English

3-[4,5-Dihydroxy-6-methyl-3-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxy-5,7-dihydroxy-2-(4-methoxyphenyl)-8-(3-methylbut-2-enyl)chromen-4-one

group of stereoisomers with the chemical formula C₃₂H₃₈O₁₄

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Statements

instance of

group of stereoisomers

0 references

1 reference

8C-substituted flavone

1 reference

inferred from

8C-substituted flavone

mass

646.226155896 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₂H₃₈O₁₄

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canonical SMILES

O=C1C(OC2OC(C)C(O)C(O)C2OC3OCC(O)C(O)C3O)=C(OC=4C1=C(O)C=C(O)C4CC=C(C)C)C=5C=CC(OC)=CC5

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Identifiers

InChI

InChI=1S/C32H38O14/c1-13(2)5-10-17-18(33)11-19(34)21-24(38)29(27(44-28(17)21)15-6-8-16(41-4)9-7-15)45-32-30(25(39)22(36)14(3)43-32)46-31-26(40)23(37)20(35)12-42-31/h5-9,11,14,20,22-23,25-26,30-37,39-40H,10,12H2,1-4H3

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InChIKey

BVDGQVAUJNUPGW-UHFFFAOYSA-N

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2 references

26 December 2021

matched by identifier from

InChIKey

BVDGQVAUJNUPGW-UHFFFAOYSA-N

1 reference

Human Metabolome Database ID

HMDB0257444

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

BVDGQVAUJNUPGW-UHFFFAOYSA-N

(Q104946464)

3-[4,5-Dihydroxy-6-methyl-3-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxy-5,7-dihydroxy-2-(4-methoxyphenyl)-8-(3-methylbut-2-enyl)chromen-4-one

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