KEGG   COMPOUND: C11905
Entry
C11905                      Compound                               

Name
Gibberellin A53 aldehyde
Formula
C20H28O4
Exact mass
332.1988
Mol weight
332.4339
Structure
Reaction
Pathway
map00904  Diterpenoid biosynthesis
Brite
Lipids [BR:br08002]
 PR  Prenol lipids
  PR01 Isoprenoids
   PR0104 C20 isoprenoids (diterpenes)
    PR010417 Gibberellins
     C11905  Gibberellin A53 aldehyde
Phytochemical compounds [BR:br08003]
 Terpenoids
  Diterpenoids (C20)
   Gibberellins
    C11905  Gibberellin A53 aldehyde
Other DBs
CAS: 85344-33-8
PubChem: 14067
ChEBI: 29601
LIPIDMAPS: LMPR0104170029
3DMET: B04378
NIKKAJI: J2.777.716C
LinkDB
KCF data

ATOM        24
            1   C1z C    29.7713  -16.1529
            2   C1y C    29.7819  -17.4683
            3   C1y C    28.6336  -15.4846
            4   C1x C    30.9196  -15.4916
            5   C1x C    30.9090  -16.8035
            6   C1y C    27.4924  -17.4755
            7   C4a C    31.0121  -18.1865
            8   C1z C    27.4924  -16.1529
            9   C1x C    28.6371  -14.1690
            10  C1z C    30.9196  -14.1762
            11  C2y C    32.0537  -14.8197
            12  C1z C    26.3440  -18.1403
            13  O4a O    31.0050  -19.6228
            14  C1x C    26.3440  -15.4846
            15  C1a C    27.4817  -14.8197
            16  C1x C    29.7784  -13.5149
            17  O1a O    32.0537  -13.5113
            18  C2a C    33.3195  -14.4819
            19  C1x C    25.1992  -17.4755
            20  C6a C    25.6721  -19.2708
            21  C1a C    27.0646  -19.4108
            22  C1x C    25.1992  -16.1529
            23  O6a O    24.3601  -19.2673
            24  O6a O    26.3298  -20.4157
BOND        27
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     1   5 1 #Up
            5     2   6 1
            6     2   7 1 #Up
            7     3   8 1
            8     3   9 1
            9     4  10 1
            10    5  11 1
            11    6  12 1
            12    7  13 2
            13    8  14 1
            14    8  15 1 #Down
            15    9  16 1
            16   10  17 1 #Down
            17   11  18 2
            18   12  19 1
            19   12  20 1 #Down
            20   12  21 1 #Up
            21   14  22 1
            22   20  23 1
            23   20  24 2
            24    6   8 1
            25   10  11 1 #Up
            26   10  16 1
            27   19  22 1

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