KEGG   COMPOUND: C00386
Entry
C00386                      Compound                               
Name
Carnosine;
Nalpha-(beta-alanyl)-L-histidine
Formula
C9H14N4O3
Exact mass
226.1066
Mol weight
226.2325
Structure
Comment
Dipeptide consists of Histidine and beta-Alanine.
Reaction
Pathway
map00340  Histidine metabolism
map00410  beta-Alanine metabolism
map01100  Metabolic pathways
Enzyme
2.1.1.22        3.4.13.18       3.4.13.20       6.3.2.11
Brite
Compounds with biological roles [BR:br08001]
 Peptides
  Peptides
   Dipeptides
    C00386  Carnosine
Other DBs
CAS: 305-84-0
PubChem: 3676
ChEBI: 15727
PDB-CCD: 8V0[PDBj]
3DMET: B00100
NIKKAJI: J5.496H
KCF data

ATOM        16
            1   C1c C    24.9200  -16.4500
            2   C1b C    23.7300  -17.1500
            3   N1b N    26.1800  -17.1500
            4   C6a C    24.9200  -15.0500
            5   C8y C    22.5400  -16.4500
            6   C5a C    27.3700  -16.4500
            7   C8x C    22.9730  -15.1242
            8   N5x N    21.0834  -16.4399
            9   C1b C    28.5600  -17.1500
            10  O5a O    27.3700  -15.0500
            11  N4x N    21.7780  -14.2682
            12  C8x C    20.6621  -15.1048
            13  C1b C    29.8200  -16.4500
            14  N1a N    31.0100  -17.1500
            15  O6a O    26.1324  -14.3500
            16  O6a O    23.7076  -14.3500
BOND        16
            1     1   2 1
            2     1   3 1
            3     1   4 1 #Up
            4     2   5 1
            5     3   6 1
            6     5   7 2
            7     5   8 1
            8     6   9 1
            9     6  10 2
            10    7  11 1
            11    8  12 2
            12    9  13 1
            13   13  14 1
            14   11  12 1
            15    4  15 2
            16    4  16 1

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