A1EBL

(3~{R})-3,7-dimethylocta-1,6-dien-3-ol

Created:	2024-09-06
Last modified:	2025-03-26

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1 entries where A1EBL is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	29
Chiral Atom Count	1
Bond Count	28
Aromatic Bond Count	0

2D diagram of A1EBL

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Chemical Component Summary
Name	(3~{R})-3,7-dimethylocta-1,6-dien-3-ol
Synonyms	Linalool, (-)-
Systematic Name (OpenEye OEToolkits)	(3~{R})-3,7-dimethylocta-1,6-dien-3-ol
Formula	C₁₀ H₁₈ O
Molecular Weight	154.249
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	CC(C)=CCC[C](C)(O)C=C
SMILES	OpenEye OEToolkits	2.0.7	CC(=CCCC(C)(C=C)O)C
Canonical SMILES	CACTVS	3.385	CC(C)=CCC[C@@](C)(O)C=C
Canonical SMILES	OpenEye OEToolkits	2.0.7	CC(=CCC[C@](C)(C=C)O)C
InChI	InChI	1.06	InChI=1S/C10H18O/c1-5-10(4,11)8-6-7-9(2)3/h5,7,11H,1,6,8H2,2-4H3/t10-/m0/s1
InChIKey	InChI	1.06	CDOSHBSSFJOMGT-JTQLQIEISA-N

Related Resource References

Resource Name	Reference
PubChem	443158
ChEMBL	CHEMBL235672
ChEBI	CHEBI:28

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