(Q104909637)

English

2-(3,5-dihydroxy-4-methoxyphenyl)-8-[2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-4-yl]-3,4-dihydro-2H-chromene-3,5,7-triol

group of stereoisomers with the chemical formula C₃₁H₂₈O₁₃

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Statements

instance of

group of stereoisomers

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subclass of

(4->8)-proanthocyanidin

1 reference

inferred from

(4->8)-proanthocyanidin

8C-substituted flavan

1 reference

inferred from

8C-substituted flavan

4C-substituted flavan

1 reference

inferred from

4C-substituted flavan

mass

608.152990956 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₁H₂₈O₁₃

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canonical SMILES

OC=1C=C(O)C2=C(OC(C3=CC=C(O)C(O)=C3)C(O)C2C=4C(O)=CC(O)=C5C4OC(C6=CC(O)=C(OC)C(O)=C6)C(O)C5)C1

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Identifiers

InChI

InChI=1S/C31H28O13/c1-42-31-20(38)5-12(6-21(31)39)28-22(40)9-14-16(34)10-19(37)25(30(14)44-28)26-24-18(36)7-13(32)8-23(24)43-29(27(26)41)11-2-3-15(33)17(35)4-11/h2-8,10,22,26-29,32-41H,9H2,1H3

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InChIKey

ADKHKBZKHGJXDZ-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

ADKHKBZKHGJXDZ-UHFFFAOYSA-N

(Q104909637)

2-(3,5-dihydroxy-4-methoxyphenyl)-8-[2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-4-yl]-3,4-dihydro-2H-chromene-3,5,7-triol

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Identifiers

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