KEGG   COMPOUND: C00954Help
Entry
C00954                      Compound                               

Name
Indole-3-acetate;
Indole-3-acetic acid;
(Indol-3-yl)acetate;
Indoleacetate;
Indoleacetic acid;
IAA
Formula
C10H9NO2
Exact mass
175.0633
Mol weight
175.184
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00380  Tryptophan metabolism
map01070  Biosynthesis of plant hormones
map01100  Metabolic pathways
map04075  Plant hormone signal transduction
Enzyme
1.2.1.3         1.2.3.7         1.13.11.-       1.14.13.168     
1.14.13.235     2.1.1.278       2.4.1.121       2.5.1.-         
3.5.1.4         3.5.1.-         3.5.5.1         6.3.2.20
Brite
Phytochemical compounds [BR:br08003]
 Alkaloids
  Alkaloids derived from tryptophan and anthranilic acid
   Indole alkaloids
    C00954  Indole-3-acetate
Pesticides [BR:br08007]
 Pesticides
  Plant growth regulators
   Auxins
    C00954  Indole-3-acetate
BRITE hierarchy
Other DBs
CAS: 87-51-4
PubChem: 4205
ChEBI: 16411
ChEMBL: CHEMBL82411
KNApSAcK: C00000100
PDB-CCD: IAC[PDBj]
3DMET: B00206
NIKKAJI: J5.156J
KCF data Show

ATOM        13
            1   C8x C    17.2200  -18.5500
            2   C8x C    17.2200  -19.9500
            3   C8x C    18.4324  -20.6500
            4   C8y C    19.6449  -19.9500
            5   C8y C    19.6449  -18.5500
            6   C8x C    18.4324  -17.8500
            7   N4x N    20.9764  -20.3826
            8   C8x C    21.7993  -19.2500
            9   C8y C    20.9764  -18.1174
            10  C1b C    21.4076  -16.7906
            11  C6a C    22.7869  -16.4974
            12  O6a O    23.7495  -17.5669
            13  O6a O    23.2163  -15.1773
BOND        14
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     4   7 1
            8     7   8 1
            9     8   9 2
            10    5   9 1
            11    9  10 1
            12   10  11 1
            13   11  12 2
            14   11  13 1

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