KEGG   COMPOUND: C11331
Entry
C11331                      Compound                               

Name
Leu-leu-tyr;
LLY
Formula
C21H33N3O5
Exact mass
407.242
Mol weight
407.5038
Structure
Other DBs
CAS: 20368-24-5
PubChem: 13506
ChEBI: 6415
NIKKAJI: J492.339A
KCF data

ATOM        29
            1   N1b N    28.6923  -20.2126
            2   C1c C    29.9008  -19.5140
            3   C6a C    31.1101  -20.2113
            4   O6a O    32.3184  -19.5125
            5   O6a O    31.1109  -21.6069
            6   C1b C    29.9000  -18.1182
            7   C8y C    31.1085  -17.4196
            8   C8x C    33.5210  -17.4162
            9   C8y C    33.5202  -16.0204
            10  C8x C    32.3110  -15.3232
            11  C8x C    31.1026  -16.0218
            12  O1a O    34.7286  -15.3218
            13  C5a C    27.4724  -19.5240
            14  O5a O    27.4655  -18.1213
            15  C1c C    26.2529  -20.2219
            16  N1b N    25.0379  -19.5225
            17  C1b C    26.2510  -21.6249
            18  C1c C    27.4660  -22.3314
            19  C1a C    27.4643  -23.7344
            20  C1a C    28.6828  -21.6279
            21  C5a C    23.8184  -20.2135
            22  O5a O    23.8115  -21.6162
            23  C1c C    22.5989  -19.5156
            24  N1a N    21.3839  -20.2150
            25  C1b C    22.5970  -18.1126
            26  C1c C    23.8120  -17.4061
            27  C1a C    23.8103  -16.0032
            28  C1a C    25.0288  -18.1096
            29  C8x C    32.3177  -18.1167
BOND        29
            1     3   5 2
            2     2   3 1
            3     7  29 2
            4    29   8 1
            5    15  16 1
            6    13  15 1
            7     1  13 1
            8    15  17 1 #Down
            9    17  18 1
            10   18  19 1
            11   18  20 1
            12   13  14 2
            13    8   9 2
            14    9  10 1
            15   10  11 2
            16   11   7 1
            17    2   6 1 #Up
            18    9  12 1
            19    1   2 1
            20    6   7 1
            21   23  24 1
            22   21  23 1
            23   16  21 1
            24   23  25 1 #Up
            25   25  26 1
            26   26  27 1
            27   26  28 1
            28   21  22 2
            29    3   4 1

» Japanese version

DBGET integrated database retrieval system