KEGG   COMPOUND: C11422Help
Entry
C11422                      Compound                               

Name
Phenanthrene;
Phenanthracene
Formula
C14H10
Exact mass
178.0783
Mol weight
178.2292
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
map00624  Polycyclic aromatic hydrocarbon degradation
map01100  Metabolic pathways
map01120  Microbial metabolism in diverse environments
map01220  Degradation of aromatic compounds
Enzyme
1.13.11.-       1.14.13.-
Brite
Carcinogens [BR:br08008]
 Group 3: Not classifiable as to its carcinogenicity to humans
  Compounds
   C11422  Phenanthrene
BRITE hierarchy
Other DBs
CAS: 85-01-8
PubChem: 13596
ChEBI: 28851
ChEMBL: CHEMBL46730
PDB-CCD: PEY[PDBj]
NIKKAJI: J3.885G
KCF data Show

ATOM        14
            1   C8x C    29.4920  -19.3994
            2   C8x C    30.7020  -18.6984
            3   C8y C    29.4886  -16.6014
            4   C8y C    30.6989  -17.3015
            5   C8x C    31.9106  -16.6034
            6   C8x C    31.9117  -15.2052
            7   C8x C    30.7013  -14.5048
            8   C8x C    29.4898  -15.2029
            9   C8y C    28.2749  -18.6984
            10  C8y C    28.2749  -17.2964
            11  C8x C    27.0607  -16.5954
            12  C8x C    25.8467  -17.2964
            13  C8x C    25.8467  -18.6984
            14  C8x C    27.0607  -19.3994
BOND        16
            1     4   5 1
            2     5   6 2
            3     6   7 1
            4     7   8 2
            5     8   3 1
            6     9   1 1
            7     1   2 2
            8     2   4 1
            9     3  10 1
            10    3   4 2
            11    9  10 2
            12   10  11 1
            13   11  12 2
            14   12  13 1
            15   13  14 2
            16   14   9 1

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