General Information of the Compound
| Compound ID |
CP0119429
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| Compound Name |
CHEBI:15727
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| Synonyms |
L-carnosine
beta-alanyl-L-histidine
carnosine
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| Structure |
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| Formula |
C9H14N4O3
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| Molecular Weight |
226.236
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| Canonical SMILES |
NCCC(=O)N[C@@H](Cc1cnc[nH]1)C(O)=O
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| InChI |
InChI=1S/C9H14N4O3/c10-2-1-8(14)13-7(9(15)16)3-6-4-11-5-12-6/h4-5,7H,1-3,10H2,(H,11,12)(H,13,14)(H,15,16)/t7-/m0/s1
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| InChIKey |
CQOVPNPJLQNMDC-ZETCQYMHSA-N
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| CAS |
305-84-0
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Clinical Information about the Compound
Drug 1 ( carnosine )
| Drug Name | carnosine | ||
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