KEGG   COMPOUND: C11297
Entry
C11297                      Compound                               
Name
N-Acetyl-leu-leu-tyr-amide;
NAc-LLY-amide
Formula
C23H36N4O5
Exact mass
448.2686
Mol weight
448.5557
Structure
Other DBs
PubChem: 13472
ChEBI: 7192
NIKKAJI: J2.773.647E
LinkDB
KCF data

ATOM        32
            1   N1b N    29.8480  -20.2506
            2   C1c C    31.0569  -19.5518
            3   C5a C    32.2665  -20.2493
            4   N1a N    33.4752  -19.5504
            5   O5a O    32.2671  -21.6455
            6   C1b C    31.0560  -18.1555
            7   C8y C    32.2648  -17.4567
            8   C8x C    33.4693  -18.1521
            9   C8x C    34.6780  -17.4533
            10  C8y C    34.6774  -16.0571
            11  C8x C    33.4678  -15.3596
            12  C8x C    32.2588  -16.0584
            13  O1a O    35.8861  -15.3582
            14  C5a C    28.6275  -19.5618
            15  O5a O    28.6206  -18.1586
            16  C1c C    27.4076  -20.2599
            17  N1b N    26.1923  -19.5603
            18  C1b C    27.4057  -21.6633
            19  C1c C    28.6211  -22.3701
            20  C1a C    28.6194  -23.7734
            21  C1a C    29.8383  -21.6663
            22  C5a C    24.9723  -20.2515
            23  O5a O    24.9654  -21.6547
            24  C1c C    23.7524  -19.5533
            25  N1b N    22.5371  -20.2530
            26  C1b C    23.7506  -18.1499
            27  C1c C    24.9659  -17.4432
            28  C1a C    24.9642  -16.0398
            29  C1a C    26.1831  -18.1469
            30  C5a C    21.3288  -19.5533
            31  C1a C    20.1187  -20.2499
            32  O5a O    21.3305  -18.1570
BOND        32
            1     2   6 1
            2     7   8 2
            3     8   9 1
            4    16  17 1
            5    14  16 1
            6     1  14 1
            7    16  18 1
            8    18  19 1
            9    19  20 1
            10   19  21 1
            11   14  15 2
            12    9  10 2
            13   10  11 1
            14   11  12 2
            15   12   7 1
            16    1   2 1
            17   10  13 1
            18    6   7 1
            19    3   4 1
            20   24  25 1
            21   22  24 1
            22   17  22 1
            23   24  26 1
            24   26  27 1
            25   27  28 1
            26   27  29 1
            27   22  23 2
            28   25  30 1
            29    3   5 2
            30   30  31 1
            31    2   3 1
            32   30  32 2

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