HL0
N-[(3S)-2-oxotetrahydrofuran-3-yl]decanamide
Created: | 2011-02-15 |
Last modified: | 2021-03-01 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 43 |
Chiral Atom Count | 1 |
Bond Count | 43 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
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Name | N-[(3S)-2-oxotetrahydrofuran-3-yl]decanamide |
Synonyms | N-decanoyl-L-homoserine lactone |
Systematic Name (OpenEye OEToolkits) | N-[(3S)-2-oxooxolan-3-yl]decanamide |
Formula | C14 H25 N O3 |
Molecular Weight | 255.353 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C1OCCC1NC(=O)CCCCCCCCC |
SMILES | CACTVS | 3.370 | CCCCCCCCCC(=O)N[CH]1CCOC1=O |
SMILES | OpenEye OEToolkits | 1.7.0 | CCCCCCCCCC(=O)NC1CCOC1=O |
Canonical SMILES | CACTVS | 3.370 | CCCCCCCCCC(=O)N[C@H]1CCOC1=O |
Canonical SMILES | OpenEye OEToolkits | 1.7.0 | CCCCCCCCCC(=O)N[C@H]1CCOC1=O |
InChI | InChI | 1.03 | InChI=1S/C14H25NO3/c1-2-3-4-5-6-7-8-9-13(16)15-12-10-11-18-14(12)17/h12H,2-11H2,1H3,(H,15,16)/t12-/m0/s1 |
InChIKey | InChI | 1.03 | TZWZKDULKILUPV-LBPRGKRZSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 10131281 |
ChEMBL | CHEMBL8799 |