KZF
2-(cyclohexylazaniumyl)ethanesulfonate
Created: | 2022-06-08 |
Last modified: | 2022-09-21 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 30 |
Chiral Atom Count | 0 |
Bond Count | 30 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
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Name | 2-(cyclohexylazaniumyl)ethanesulfonate |
Systematic Name (OpenEye OEToolkits) | 2-(cyclohexylazaniumyl)ethanesulfonate |
Formula | C8 H17 N O3 S |
Molecular Weight | 207.29 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | [O-][S](=O)(=O)CC[NH2+]C1CCCCC1 |
SMILES | OpenEye OEToolkits | 2.0.7 | C1CCC(CC1)[NH2+]CCS(=O)(=O)[O-] |
Canonical SMILES | CACTVS | 3.385 | [O-][S](=O)(=O)CC[NH2+]C1CCCCC1 |
Canonical SMILES | OpenEye OEToolkits | 2.0.7 | C1CCC(CC1)[NH2+]CCS(=O)(=O)[O-] |
InChI | InChI | 1.06 | InChI=1S/C8H17NO3S/c10-13(11,12)7-6-9-8-4-2-1-3-5-8/h8-9H,1-7H2,(H,10,11,12) |
InChIKey | InChI | 1.06 | MKWKNSIESPFAQN-UHFFFAOYSA-N |
Drug Info: DrugBank
DrugBank ID | DB03309 |
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Name | N-cyclohexyltaurine |
Groups | experimental |
Synonyms |
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Categories |
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CAS number | 103-47-9 |
Drug Targets
Name | Target Sequence | Pharmacological Action | Actions |
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Sulfotransferase family cytosolic 2B member 1 | MDGPAEPQIPGLWDTYEDDISEISQKLPGEYFRYKGVPFPVGLYSLESIS... | unknown | |
Nitrite reductase | MRQRTPFARPGLLASAALALVLGPLAASAQEQVAPPKDPAAALEDHKTRT... | unknown | |
Homeobox protein engrailed-2 | MEENDPKPGEAAAAVEGQRQPESSPGGGSGGGGGSSPGEADTGRRRALML... | unknown | |
Ribonuclease PH | MNRPSGRAADQLRPIRITRHYTKHAEGSVLVEFGDTKVICTVSAESGVPR... | unknown | |
Cyanovirin-N | LGKFSQTCYNSAIQGSVLTSTCERTNGGYNTSSIDLNSVIENVDGSLKWQ... | unknown | |
View More |
Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison
T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS.
Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682
Related Resource References
Resource Name | Reference |
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PubChem | 3852474, 66898 |
ChEBI | CHEBI:44302 |