KEGG   COMPOUND: C16527Help
Entry
C16527                      Compound                               

Name
Adrenic acid;
7,10,13,16-Docosatetraenoic acid;
(7Z,10Z,13Z,16Z)-Docosa-7,10,13,16-tetraenoic acid;
7Z,10Z,13Z,16Z-Docosatetraenoic acid
Formula
C22H36O2
Exact mass
332.2715
Mol weight
332.52
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map01040  Biosynthesis of unsaturated fatty acids
map04216  Ferroptosis
Enzyme
3.1.2.-
Brite
Lipids [BR:br08002]
 FA  Fatty acyls
  FA01 Fatty Acids and Conjugates
   FA0103 Unsaturated fatty acids
    Polyunsaturated fatty acids
     C16527  (7Z,10Z,13Z,16Z)-Docosatetra-7,10,13,16-enoic acid
  FA04 Docosanoids
   C16527  (7Z,10Z,13Z,16Z)-Docosa-7,10,13,16-tetraenoic acid
BRITE hierarchy
Other DBs
CAS: 28874-58-0
PubChem: 51090856
ChEBI: 53487
ChEMBL: CHEMBL1491103
LIPIDMAPS: LMFA01030178
LipidBank: DFA0217
NIKKAJI: J13.758H
LinkDB All DBs
KCF data Show

ATOM        24
            1   C1b C    13.9300  -21.9100
            2   C1b C    12.7400  -21.2100
            3   C1b C    11.4800  -21.9100
            4   C6a C    10.2200  -21.2100
            5   O6a O     9.0300  -21.9100
            6   O6a O    10.2200  -19.8100
            7   C1b C    15.1200  -21.2100
            8   C1b C    16.3800  -21.9100
            9   C2b C    17.5700  -21.2100
            10  C2b C    18.9700  -21.2100
            11  C1b C    20.2300  -21.8400
            12  C2b C    21.4200  -21.1400
            13  C2b C    22.8200  -21.1400
            14  C1b C    24.0100  -21.8400
            15  C2b C    25.2000  -21.1400
            16  C2b C    26.6000  -21.1400
            17  C1b C    27.8600  -21.7700
            18  C2b C    29.1200  -21.0700
            19  C2b C    30.5200  -21.0700
            20  C1b C    31.7800  -21.7700
            21  C1b C    32.9700  -21.0700
            22  C1b C    34.1600  -21.7700
            23  C1b C    35.4200  -21.0700
            24  C1a C    36.6100  -21.7700
BOND        23
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     4   6 2
            6     1   7 1
            7     7   8 1
            8     9   8 1
            9     9  10 2
            10   10  11 1
            11   11  12 1
            12   12  13 2
            13   13  14 1
            14   15  14 1
            15   15  16 2
            16   16  17 1
            17   17  18 1
            18   18  19 2
            19   19  20 1
            20   20  21 1
            21   21  22 1
            22   22  23 1
            23   23  24 1

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