KEGG   COMPOUND: C09892
Entry
C09892                      Compound                               
Name
Phlegmarine
Formula
C16H30N2
Exact mass
250.2409
Mol weight
250.4228
Structure
Other DBs
CAS: 66834-87-5
PubChem: 12078
ChEBI: 8109
KNApSAcK: C00001954
3DMET: B03355
NIKKAJI: J2.771.295I
LinkDB
KCF data

ATOM        18
            1   C1y C    24.2962  -21.7757
            2   C1y C    23.0847  -22.4747
            3   C1b C    24.3021  -20.3719
            4   C1x C    25.5136  -22.4747
            5   C1y C    23.0904  -23.8786
            6   C1x C    21.8673  -21.7816
            7   C1y C    25.5136  -19.6787
            8   C1y C    25.5136  -23.8786
            9   C1x C    24.2962  -24.5776
            10  N1x N    21.8789  -24.5776
            11  C1x C    20.6558  -22.4863
            12  C1x C    25.5136  -18.2809
            13  N1x N    26.7253  -20.3719
            14  C1a C    26.7310  -24.5657
            15  C1x C    20.6674  -23.8902
            16  C1x C    26.7253  -17.5760
            17  C1x C    27.9368  -19.6787
            18  C1x C    27.9368  -18.2809
BOND        20
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 1
            7     4   8 1
            8     5   9 1
            9     5  10 1
            10    6  11 1
            11    7  12 1
            12    7  13 1
            13    8  14 1 #Up
            14   10  15 1
            15   12  16 1
            16   13  17 1
            17   16  18 1
            18    8   9 1
            19   11  15 1
            20   17  18 1

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