(Q105328096)

English

(1R,1'S,2R,2'S,4R,6S)-2',4-dibromo-1'-chloro-1,1',3,3-tetramethylspiro[7-oxabicyclo[4.1.0]heptane-2,4'-cyclohexane]

chemical compound

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instance of

type of chemical entity

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subclass of

2',4-Dibromo-1'-chloro-1,1',3,3-tetramethylspiro[7-oxabicyclo[4.1.0]heptane-2,4'-cyclohexane]

1 reference

based on heuristic

inferred from SMILES

(1S,4R)-2',4-dibromo-1'-chloro-1,1',3,3-tetramethylspiro[7-oxabicyclo[4.1.0]heptane-2,4'-cyclohexane]

1 reference

based on heuristic

inferred from SMILES

(1S,2R,4R,6R)-2',4-dibromo-1'-chloro-1,1',3,3-tetramethylspiro[7-oxabicyclo[4.1.0]heptane-2,4'-cyclohexane]

1 reference

based on heuristic

inferred from SMILES

mass

411.980417236 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

2,10-Diburomo-3-chloro-7,8-epoxychamigrane

1 reference

based on heuristic

inferred from InChI

(1S,1'S,2R,2'S,4R,6R)-2',4-dibromo-1'-chloro-1,1',3,3-tetramethylspiro[7-oxabicyclo[4.1.0]heptane-2,4'-cyclohexane]

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₅H₂₃Br₂ClO

0 references

canonical SMILES

ClC1(C)CCC2(CC1Br)C3(OC3CC(Br)C2(C)C)C

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isomeric SMILES

CC1(C)[C@H](Br)C[C@@H]2O[C@]2(C)[C@@]12CC[C@](C)(Cl)[C@@H](Br)C2

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found in taxon

Laurencia dendroidea

1 reference

stated in

Chamigrane metabolites from Laurencia obtusa and L. scoparia

Laurencia scoparia

1 reference

stated in

Chamigrane metabolites from Laurencia obtusa and L. scoparia

Identifiers

InChI

InChI=1S/C15H23Br2ClO/c1-12(2)9(16)7-11-14(4,19-11)15(12)6-5-13(3,18)10(17)8-15/h9-11H,5-8H2,1-4H3/t9-,10+,11+,13+,14+,15-/m1/s1

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InChIKey

XHGHPMZGEBNXLW-MIEIIINRSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

XHGHPMZGEBNXLW-MIEIIINRSA-N

(Q105328096)

(1R,1'S,2R,2'S,4R,6S)-2',4-dibromo-1'-chloro-1,1',3,3-tetramethylspiro[7-oxabicyclo[4.1.0]heptane-2,4'-cyclohexane]

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