(Q104968180)

English

1-(4-Hydroxy-3,5-dimethoxy-phenyl)-2-[4-[3-(4-hydroxy-3,5-dimethoxy-phenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-2,6-dimethoxy-phenoxy]propane-1,3-diol

group of stereoisomers with the chemical formula C₃₃H₄₀O₁₃

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Statements

instance of

group of stereoisomers

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subclass of

chemical compound

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mass

644.24689134 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₃H₄₀O₁₃

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canonical SMILES

OC1=C(OC)C=C(C=C1OC)C(O)C(OC2=C(OC)C=C(C=C2OC)C3OCC4C(OCC34)C5=CC(OC)=C(O)C(OC)=C5)CO

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found in taxon

Tarenna

1 reference

stated in

Mixed lignan-neolignans from Tarenna attenuata

Identifiers

InChI

InChI=1S/C33H40O13/c1-38-21-7-16(8-22(39-2)29(21)36)28(35)27(13-34)46-33-25(42-5)11-18(12-26(33)43-6)32-20-15-44-31(19(20)14-45-32)17-9-23(40-3)30(37)24(10-17)41-4/h7-12,19-20,27-28,31-32,34-37H,13-15H2,1-6H3

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InChIKey

CQPUHIMEOUJAQQ-UHFFFAOYSA-N

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1 reference

17 September 2022

inferred from InChIKey

1 reference

Human Metabolome Database ID

HMDB0304576

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

CQPUHIMEOUJAQQ-UHFFFAOYSA-N

(Q104968180)

1-(4-Hydroxy-3,5-dimethoxy-phenyl)-2-[4-[3-(4-hydroxy-3,5-dimethoxy-phenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-2,6-dimethoxy-phenoxy]propane-1,3-diol

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Identifiers

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