(Q104946070)

English

(2R)-2alpha-(2-Pentene-4-ynyl)-5alpha-[(S)-1-bromo-3-hexenyl]tetrahydrofuran-3alpha-ol acetate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

[5-(1-Bromohex-3-enyl)-2-pent-2-en-4-ynyloxolan-3-yl] acetate

1 reference

based on heuristic

inferred from SMILES

mass

354.083056696 dalton

1 reference

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

[(2R,3R,5R)-5-[(E,1S)-1-bromohex-3-enyl]-2-[(Z)-pent-2-en-4-ynyl]oxolan-3-yl] acetate

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₇H₂₃BrO₃

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canonical SMILES

O=C(OC1CC(OC1CC=CC#C)C(Br)CC=CCC)C

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isomeric SMILES

C#C/C=C/C[C@H]1O[C@@H]([C@@H](Br)C/C=C/CC)C[C@H]1OC(C)=O

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found in taxon

Laurencia nipponica

2 references

stated in

KUMAUSYNES AND DEACETYLKUMAUSYNES, FOUR NEW HALOGENATED C-15 ACETYLENES FROM THE RED ALGALAURENCIA NIPPONICAYAMADA

stated in

Structures of Halogenated Chamigrene Derivatives, Minor Constituents from the Red AlgaLaurencia nipponicaYamadan

Identifiers

InChI

InChI=1S/C17H23BrO3/c1-4-6-8-10-14(18)16-12-17(20-13(3)19)15(21-16)11-9-7-5-2/h2,6-9,14-17H,4,10-12H2,1,3H3/b8-6+,9-7+/t14-,15+,16+,17+/m0/s1

0 references

InChIKey

BUFQJMZKMZGEFE-GIGMYMNUSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

BUFQJMZKMZGEFE-GIGMYMNUSA-N

1 reference

(Q104946070)

(2R)-2alpha-(2-Pentene-4-ynyl)-5alpha-[(S)-1-bromo-3-hexenyl]tetrahydrofuran-3alpha-ol acetate

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Identifiers

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