KEGG   COMPOUND: C05730Help
Entry
C05730                      Compound                               

Name
Glutathionylspermidine;
N1-(gamma-L-Glutamyl-L-cysteinyl-glycyl)-spermidine
Formula
C17H34N6O5S
Exact mass
434.2311
Mol weight
434.5541
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Glutathione metabolism
Metabolic pathways
Enzyme
3.5.1.78        3.5.1.-         6.3.1.8         6.3.1.9
Other DBs
CAS: 
33932-35-3
PubChem: 
ChEBI: 
PDB-CCD: 
3DMET: 
KCF data Show

ATOM        29
            1   C1c C    19.6087  -16.8902
            2   N1b N    18.4175  -17.6246
            3   C5a C    20.8425  -17.5462
            4   C1b C    19.5659  -15.4851
            5   C5a C    17.1836  -16.9613
            6   N1b N    22.0337  -16.8116
            7   O5a O    20.8853  -18.9442
            8   S1a S    20.7498  -14.7504
            9   C1b C    15.9926  -17.7032
            10  O5a O    17.1410  -15.5635
            11  C1b C    23.2674  -17.4678
            12  C1b C    14.7586  -17.0399
            13  C5a C    24.4514  -16.7332
            14  C1c C    13.5747  -17.7816
            15  N1b N    25.6854  -17.3892
            16  O5a O    24.4086  -15.3352
            17  C6a C    12.3337  -17.1183
            18  N1a N    13.6175  -19.1796
            19  C1b C    26.8765  -16.6548
            20  O6a O    11.1783  -17.9171
            21  O6a O    12.2852  -15.7203
            22  C1b C    28.1103  -17.3181
            23  C1b C    29.3015  -16.5762
            24  N1b N    30.5353  -17.2395
            25  C1b C    31.7264  -16.4978
            26  C1b C    32.9602  -17.1611
            27  C1b C    34.1441  -16.4194
            28  C1b C    35.3781  -17.0827
            29  N1a N    36.5693  -16.3408
BOND        28
            1     1   2 1
            2     1   3 1
            3     1   4 1 #Up
            4     2   5 1
            5     3   6 1
            6     3   7 2
            7     4   8 1
            8     5   9 1
            9     5  10 2
            10    6  11 1
            11    9  12 1
            12   11  13 1
            13   12  14 1
            14   13  15 1
            15   13  16 2
            16   14  17 1
            17   14  18 1 #Down
            18   15  19 1
            19   17  20 1
            20   17  21 2
            21   19  22 1
            22   22  23 1
            23   23  24 1
            24   24  25 1
            25   25  26 1
            26   26  27 1
            27   27  28 1
            28   28  29 1

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