(Q104167693)

English

8-(6-Acetyloxy-2,8-dimethyl-3,4-dihydrochromen-2-yl)-6-methyl-2-(4-methylpentyl)octanoic acid

group of stereoisomers with the chemical formula C₂₈H₄₄O₅

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Statements

instance of

group of stereoisomers

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1 reference

460.318874508 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₈H₄₄O₅

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canonical SMILES

O=C(OC=1C=C(C=2OC(C)(CCC2C1)CCC(C)CCCC(C(=O)O)CCCC(C)C)C)C

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found in taxon

Iryanthera grandis

1 reference

stated in

Tocotrienols from Iryanthera grandis

Identifiers

InChI

InChI=1S/C28H44O5/c1-19(2)9-7-11-23(27(30)31)12-8-10-20(3)13-15-28(6)16-14-24-18-25(32-22(5)29)17-21(4)26(24)33-28/h17-20,23H,7-16H2,1-6H3,(H,30,31)

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InChIKey

HCEMNFCIOCZDKL-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

HCEMNFCIOCZDKL-UHFFFAOYSA-N

(Q104167693)

8-(6-Acetyloxy-2,8-dimethyl-3,4-dihydrochromen-2-yl)-6-methyl-2-(4-methylpentyl)octanoic acid

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Identifiers

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