(Q105348433)

English

2-[12-(3,4-Methylenedioxyphenyl)dodecyl]-4-hydroxy-2,3,4,6,7,8-hexahydro-5H-1-benzopyran-5-one

group of stereoisomers with the chemical formula C₂₈H₄₀O₅

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instance of

group of stereoisomers

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subclass of

chemical compound

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mass

456.28757438 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₂₈H₄₀O₅

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canonical SMILES

O=C1C2=C(OC(CCCCCCCCCCCCC3=CC=C4OCOC4=C3)CC2O)CCC1

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Identifiers

InChI

InChI=1S/C28H40O5/c29-23-14-11-15-26-28(23)24(30)19-22(33-26)13-10-8-6-4-2-1-3-5-7-9-12-21-16-17-25-27(18-21)32-20-31-25/h16-18,22,24,30H,1-15,19-20H2

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InChIKey

YHJGSFFBACPLMU-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

YHJGSFFBACPLMU-UHFFFAOYSA-N

1 reference

(Q105348433)

2-[12-(3,4-Methylenedioxyphenyl)dodecyl]-4-hydroxy-2,3,4,6,7,8-hexahydro-5H-1-benzopyran-5-one

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