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CCB : Summary
Code
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CCB
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One-letter code
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X
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Molecule name
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CYCLOBUTYL(CYCLOPENTYL)FORMAMIDE
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Systematic names
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Formula
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C10 H17 N O
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Formal charge
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0
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Molecular weight
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167.248 Da
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SMILES
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Type | Program | Version | Descriptor |
SMILES
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ACDLabs |
10.04 |
O=CN(C1CCC1)C2CCCC2 |
SMILES
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CACTVS |
3.341 |
O=CN(C1CCCC1)C2CCC2 |
SMILES
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OpenEye OEToolkits |
1.5.0 |
C1CCC(C1)N(C=O)C2CCC2 |
Canonical SMILES
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CACTVS |
3.341 |
O=CN(C1CCCC1)C2CCC2 |
Canonical SMILES
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OpenEye OEToolkits |
1.5.0 |
C1CCC(C1)N(C=O)C2CCC2 |
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IUPAC InChI | InChI=1S/C10H17NO/c12-8-11(10-6-3-7-10)9-4-1-2-5-9/h8-10H,1-7H2 |
IUPAC InChI key | DWGVYBRKKSJLNS-UHFFFAOYSA-N |
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wwPDB Information |
Atom count
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29 (12 without Hydrogen)
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Polymer type
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Bound ligand
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Type description
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NON-POLYMER
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Type code
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HETAIN
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Is modified
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No
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Standard parent
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Not Assigned
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Defined at
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2004-07-26
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Last modified at
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2020-06-17
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Status
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Released
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Obsoleted
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Not Assigned
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