(Q105034962)

English

(1S,2R,12Z,14R,15S,16S)-16-chloro-2-ethyl-15-hydroxy-3-oxabicyclo[12.3.0]heptadec-12-en-4-one

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

16-Chloro-2-ethyl-15-hydroxy-3-oxabicyclo[12.3.0]heptadec-12-en-4-one

1 reference

based on heuristic

inferred from SMILES

mass

328.180522468 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(1R,2S,12Z,14R,15R,16R)-16-chloro-2-ethyl-15-hydroxy-3-oxabicyclo[12.3.0]heptadec-12-en-4-one

2 references

based on heuristic

inferred from InChIKey

1 reference

(1R,2S,14S,15R,16R)-16-chloro-2-ethyl-15-hydroxy-3-oxabicyclo[12.3.0]heptadec-12-en-4-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₈H₂₉ClO₃

0 references

canonical SMILES

O=C1OC(CC)C2CC(Cl)C(O)C2C=CCCCCCCC1

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isomeric SMILES

CC[C@H]1OC(=O)CCCCCCC/C=C\[C@H]2[C@H](O)[C@@H](Cl)C[C@H]12

0 references

found in taxon

Eisenia bicyclis

1 reference

stated in

Novel Oxylipin Metabolites from the Brown AlgaEisenia bicyclis

Identifiers

InChI

InChI=1S/C18H29ClO3/c1-2-16-14-12-15(19)18(21)13(14)10-8-6-4-3-5-7-9-11-17(20)22-16/h8,10,13-16,18,21H,2-7,9,11-12H2,1H3/b10-8-/t13-,14+,15+,16-,18+/m1/s1

0 references

InChIKey

HXFOJGYVWJVNOO-DLVZFCOASA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

HXFOJGYVWJVNOO-DLVZFCOASA-N

(Q105034962)

(1S,2R,12Z,14R,15S,16S)-16-chloro-2-ethyl-15-hydroxy-3-oxabicyclo[12.3.0]heptadec-12-en-4-one

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