KEGG   COMPOUND: C10802
Entry
C10802                      Compound                               
Name
5-(Heptadec-12-enyl)resorcinol
Formula
C23H38O2
Exact mass
346.2872
Mol weight
346.5466
Structure
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK15 Phenolic lipids
   PK1503 Alkyl resorcinols and derivatives
    C10802  5-(Heptadec-12-enyl)resorcinol
Other DBs
CAS: 103462-06-2
PubChem: 12985
ChEBI: 2022
LIPIDMAPS: LMPK15030026
KNApSAcK: C00002655
3DMET: B04136
NIKKAJI: J2.037.795J
LinkDB
KCF data

ATOM        25
            1   C8x C    20.9445  -16.9832
            2   C8y C    20.9445  -18.3869
            3   C8x C    22.1569  -19.0852
            4   C8y C    23.3693  -18.3869
            5   C8x C    23.3693  -16.9832
            6   C8y C    22.1569  -16.2778
            7   O1a O    22.1586  -14.8743
            8   O1a O    19.7284  -19.0857
            9   C1b C    24.5770  -19.0781
            10  C1b C    25.7903  -18.3798
            11  C1b C    27.0035  -19.0710
            12  C1b C    28.2166  -18.3727
            13  C1b C    29.4298  -19.0641
            14  C1b C    30.6431  -18.3658
            15  C1b C    31.8492  -19.0570
            16  C1b C    33.0623  -18.3587
            17  C1b C    34.2756  -19.0498
            18  C1b C    35.4888  -18.3516
            19  C1b C    36.7019  -19.0429
            20  C2b C    37.9152  -18.3446
            21  C2b C    37.9080  -16.9409
            22  C1b C    36.6880  -16.2416
            23  C1b C    35.4746  -16.9409
            24  C1b C    34.2615  -16.2355
            25  C1a C    33.0483  -16.9409
BOND        25
            1     6   1 1
            2    12  13 1
            3    13  14 1
            4     6   7 1
            5    14  15 1
            6     1   2 2
            7    15  16 1
            8     2   8 1
            9    16  17 1
            10    2   3 1
            11   17  18 1
            12    4   9 1
            13   18  19 1
            14    3   4 2
            15   19  20 1
            16    9  10 1
            17   20  21 2
            18    4   5 1
            19   21  22 1
            20   10  11 1
            21   22  23 1
            22    5   6 2
            23   23  24 1
            24   11  12 1
            25   24  25 1

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