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Showing metabocard for Phenazine (HMDB0256395)

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Record Information
Version5.0
StatusDetected but not Quantified
Creation Date2021-09-11 16:49:34 UTC
Update Date2021-09-26 23:12:01 UTC
HMDB IDHMDB0256395
Secondary Accession NumbersNone
Metabolite Identification
Common NamePhenazine
Descriptionphenazine, also known as acridizine or azophenylene, belongs to the class of organic compounds known as phenazines and derivatives. These are polycyclic aromatic compounds containing a phenazine moiety, which is a linear tricyclic system that consists of a two benzene rings joined by a pyrazine ring. Based on a literature review very few articles have been published on phenazine. This compound has been identified in human blood as reported by (PMID: 31557052 ). Phenazine is not a naturally occurring metabolite and is only found in those individuals exposed to this compound or its derivatives. Technically Phenazine is part of the human exposome. The exposome can be defined as the collection of all the exposures of an individual in a lifetime and how those exposures relate to health. An individual's exposure begins before birth and includes insults from environmental and occupational sources.
Structure
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MOL3D MOLSDF3D SDFPDB3D PDBSMILESInChI

MOL for HMDB0256395 (Phenazine)


  Mrv1533004271515312D          

 14 16  0  0  0  0            999 V2000
    1.4289   -2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -1.2375    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0013   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7158   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7158   -2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0013   -2.8875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868   -2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -2.8875    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -2.8875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
  6 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
  4 13  1  0  0  0  0
 13 14  2  0  0  0  0
  1 14  1  0  0  0  0
M  END
Download

3D MOL for HMDB0256395 (Phenazine)

HMDB0256395
     RDKit          3D
Phenazine
 22 24  0  0  0  0  0  0  0  0999 V2000
   -3.5854    0.4616   -0.1051 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5251   -0.8789   -0.4174 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2724   -1.4412   -0.5105 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1051   -0.7031   -0.3017 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0979   -1.3072   -0.4062 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2165   -0.5904   -0.2039 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4585   -1.2198   -0.3132 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6140   -0.5058   -0.1104 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4954    0.8328    0.1996 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2742    1.4607    0.3091 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0898    0.7475    0.1057 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0966    1.3715    0.2154 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2287    0.6346    0.0079 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4759    1.2156    0.1057 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5604    0.9246   -0.0267 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4347   -1.4735   -0.5846 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1792   -2.4989   -0.7555 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5521   -2.2678   -0.5558 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6045   -0.9400   -0.1817 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4137    1.3921    0.3588 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1581    2.4982    0.5487 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5112    2.2874    0.3557 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  2  0
 10 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  2  0
 14  1  1  0
 13  4  1  0
 11  6  1  0
  1 15  1  0
  2 16  1  0
  3 17  1  0
  7 18  1  0
  8 19  1  0
  9 20  1  0
 10 21  1  0
 14 22  1  0
M  END
Download

3D SDF for HMDB0256395 (Phenazine)


  Mrv1533004271515312D          

 14 16  0  0  0  0            999 V2000
    1.4289   -2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -1.2375    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0013   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7158   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7158   -2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0013   -2.8875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868   -2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -2.8875    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -2.8875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
  6 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
  4 13  1  0  0  0  0
 13 14  2  0  0  0  0
  1 14  1  0  0  0  0
M  END
> <DATABASE_ID>
HMDB0256395

> <DATABASE_NAME>
hmdb

> <SMILES>
C1=CC2=NC3=CC=CC=C3N=C2C=C1

> <INCHI_IDENTIFIER>
InChI=1S/C12H8N2/c1-2-6-10-9(5-1)13-11-7-3-4-8-12(11)14-10/h1-8H

> <INCHI_KEY>
PCNDJXKNXGMECE-UHFFFAOYSA-N

> <FORMULA>
C12H8N2

> <MOLECULAR_WEIGHT>
180.21

> <EXACT_MASS>
180.068748266

> <JCHEM_ACCEPTOR_COUNT>
2

> <JCHEM_ATOM_COUNT>
22

> <JCHEM_AVERAGE_POLARIZABILITY>
19.416342862044853

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
phenazine

> <ALOGPS_LOGP>
2.82

> <JCHEM_LOGP>
3.0602557779999993

> <ALOGPS_LOGS>
-2.94

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
3

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA_STRONGEST_BASIC>
2.7024626869731345

> <JCHEM_POLAR_SURFACE_AREA>
25.78

> <JCHEM_REFRACTIVITY>
53.1566

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
2.07e-01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
phenazine

> <JCHEM_VEBER_RULE>
1

$$$$
Download

3D-SDF for HMDB0256395 (Phenazine)

HMDB0256395
     RDKit          3D
Phenazine
 22 24  0  0  0  0  0  0  0  0999 V2000
   -3.5854    0.4616   -0.1051 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5251   -0.8789   -0.4174 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2724   -1.4412   -0.5105 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1051   -0.7031   -0.3017 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0979   -1.3072   -0.4062 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2165   -0.5904   -0.2039 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4585   -1.2198   -0.3132 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6140   -0.5058   -0.1104 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4954    0.8328    0.1996 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2742    1.4607    0.3091 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0898    0.7475    0.1057 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0966    1.3715    0.2154 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2287    0.6346    0.0079 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4759    1.2156    0.1057 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5604    0.9246   -0.0267 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4347   -1.4735   -0.5846 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1792   -2.4989   -0.7555 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5521   -2.2678   -0.5558 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6045   -0.9400   -0.1817 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4137    1.3921    0.3588 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1581    2.4982    0.5487 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5112    2.2874    0.3557 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  2  0
 10 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  2  0
 14  1  1  0
 13  4  1  0
 11  6  1  0
  1 15  1  0
  2 16  1  0
  3 17  1  0
  7 18  1  0
  8 19  1  0
  9 20  1  0
 10 21  1  0
 14 22  1  0
M  END
Download

PDB for HMDB0256395 (Phenazine)

HEADER    PROTEIN                                 27-APR-15   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   27-APR-15         0                                  
HETATM    1  C   UNK     0       2.667  -4.620   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       2.667  -3.080   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       4.001  -2.310   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       5.335  -3.080   0.000  0.00  0.00           C+0
HETATM    5  N   UNK     0       6.668  -2.310   0.000  0.00  0.00           N+0
HETATM    6  C   UNK     0       8.002  -3.080   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       9.336  -2.310   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      10.669  -3.080   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0      10.669  -4.620   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       9.336  -5.390   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       8.002  -4.620   0.000  0.00  0.00           C+0
HETATM   12  N   UNK     0       6.668  -5.390   0.000  0.00  0.00           N+0
HETATM   13  C   UNK     0       5.335  -4.620   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       4.001  -5.390   0.000  0.00  0.00           C+0
CONECT    1    2   14                                                       
CONECT    2    1    3                                                       
CONECT    3    2    4                                                       
CONECT    4    3    5   13                                                  
CONECT    5    4    6                                                       
CONECT    6    5    7   11                                                  
CONECT    7    6    8                                                       
CONECT    8    7    9                                                       
CONECT    9    8   10                                                       
CONECT   10    9   11                                                       
CONECT   11   10    6   12                                                  
CONECT   12   11   13                                                       
CONECT   13   12    4   14                                                  
CONECT   14   13    1                                                       
MASTER        0    0    0    0    0    0    0    0   14    0   32    0
END
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3D PDB for HMDB0256395 (Phenazine)

COMPND    HMDB0256395
HETATM    1  C1  UNL     1      -3.585   0.462  -0.105  1.00  0.00           C  
HETATM    2  C2  UNL     1      -3.525  -0.879  -0.417  1.00  0.00           C  
HETATM    3  C3  UNL     1      -2.272  -1.441  -0.511  1.00  0.00           C  
HETATM    4  C4  UNL     1      -1.105  -0.703  -0.302  1.00  0.00           C  
HETATM    5  N1  UNL     1       0.098  -1.307  -0.406  1.00  0.00           N  
HETATM    6  C5  UNL     1       1.216  -0.590  -0.204  1.00  0.00           C  
HETATM    7  C6  UNL     1       2.458  -1.220  -0.313  1.00  0.00           C  
HETATM    8  C7  UNL     1       3.614  -0.506  -0.110  1.00  0.00           C  
HETATM    9  C8  UNL     1       3.495   0.833   0.200  1.00  0.00           C  
HETATM   10  C9  UNL     1       2.274   1.461   0.309  1.00  0.00           C  
HETATM   11  C10 UNL     1       1.090   0.748   0.106  1.00  0.00           C  
HETATM   12  N2  UNL     1      -0.097   1.372   0.215  1.00  0.00           N  
HETATM   13  C11 UNL     1      -1.229   0.635   0.008  1.00  0.00           C  
HETATM   14  C12 UNL     1      -2.476   1.216   0.106  1.00  0.00           C  
HETATM   15  H1  UNL     1      -4.560   0.925  -0.027  1.00  0.00           H  
HETATM   16  H2  UNL     1      -4.435  -1.474  -0.585  1.00  0.00           H  
HETATM   17  H3  UNL     1      -2.179  -2.499  -0.755  1.00  0.00           H  
HETATM   18  H4  UNL     1       2.552  -2.268  -0.556  1.00  0.00           H  
HETATM   19  H5  UNL     1       4.605  -0.940  -0.182  1.00  0.00           H  
HETATM   20  H6  UNL     1       4.414   1.392   0.359  1.00  0.00           H  
HETATM   21  H7  UNL     1       2.158   2.498   0.549  1.00  0.00           H  
HETATM   22  H8  UNL     1      -2.511   2.287   0.356  1.00  0.00           H  
CONECT    1    2    2   14   15
CONECT    2    3   16
CONECT    3    4    4   17
CONECT    4    5   13
CONECT    5    6    6
CONECT    6    7   11
CONECT    7    8    8   18
CONECT    8    9   19
CONECT    9   10   10   20
CONECT   10   11   21
CONECT   11   12   12
CONECT   12   13
CONECT   13   14   14
CONECT   14   22
END
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SMILES for HMDB0256395 (Phenazine)

C1=CC2=NC3=CC=CC=C3N=C2C=C1
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INCHI for HMDB0256395 (Phenazine)

InChI=1S/C12H8N2/c1-2-6-10-9(5-1)13-11-7-3-4-8-12(11)14-10/h1-8H
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View in JSmolView Stereo Labels
Synonyms
ValueSource
9,10-DiazaanthraceneChEBI
AcridizineChEBI
AzophenyleneChEBI
Dibenzo-p-diazineChEBI
DibenzoparadiazineChEBI
DibenzopyrazineChEBI
Chemical FormulaC12H8N2
Average Molecular Weight180.21
Monoisotopic Molecular Weight180.068748266
IUPAC Namephenazine
Traditional Namephenazine
CAS Registry NumberNot Available
SMILES
C1=CC2=NC3=CC=CC=C3N=C2C=C1
InChI Identifier
InChI=1S/C12H8N2/c1-2-6-10-9(5-1)13-11-7-3-4-8-12(11)14-10/h1-8H
InChI KeyPCNDJXKNXGMECE-UHFFFAOYSA-N
Chemical Taxonomy
Description Belongs to the class of organic compounds known as phenazines and derivatives. These are polycyclic aromatic compounds containing a phenazine moiety, which is a linear tricyclic system that consists of a two benzene rings joined by a pyrazine ring.
KingdomOrganic compounds
Super ClassOrganoheterocyclic compounds
ClassDiazanaphthalenes
Sub ClassBenzodiazines
Direct ParentPhenazines and derivatives
Alternative Parents
Substituents
  • Phenazine
  • Benzenoid
  • Pyrazine
  • Heteroaromatic compound
  • Azacycle
  • Organic nitrogen compound
  • Organopnictogen compound
  • Hydrocarbon derivative
  • Organonitrogen compound
  • Aromatic heteropolycyclic compound
Molecular FrameworkAromatic heteropolycyclic compounds
External Descriptors
Ontology
Physiological effectNot Available
Disposition
Biological location
ProcessNot Available
RoleNot Available
Physical Properties
StateNot Available
Experimental Molecular Properties
PropertyValueReference
Melting PointNot AvailableNot Available
Boiling PointNot AvailableNot Available
Water SolubilityNot AvailableNot Available
LogPNot AvailableNot Available
Experimental Chromatographic PropertiesNot Available
Predicted Molecular Properties
PropertyValueSource
logP2.82ALOGPS
logP3.06ChemAxon
logS-2.9ALOGPS
pKa (Strongest Basic)2.7ChemAxon
Physiological Charge0ChemAxon
Hydrogen Acceptor Count2ChemAxon
Hydrogen Donor Count0ChemAxon
Polar Surface Area25.78 ŲChemAxon
Rotatable Bond Count0ChemAxon
Refractivity53.16 m³·mol⁻¹ChemAxon
Polarizability19.42 ųChemAxon
Number of Rings3ChemAxon
BioavailabilityYesChemAxon
Rule of FiveYesChemAxon
Ghose FilterYesChemAxon
Veber's RuleYesChemAxon
MDDR-like RuleNoChemAxon
Predicted Chromatographic Properties

Predicted Collision Cross Sections

PredictorAdduct TypeCCS Value (Å2)Reference
DeepCCS[M+H]+143.32230932474
DeepCCS[M-H]-140.92630932474
DeepCCS[M-2H]-175.830932474
DeepCCS[M+Na]+150.30230932474
AllCCS[M+H]+139.332859911
AllCCS[M+H-H2O]+134.932859911
AllCCS[M+NH4]+143.432859911
AllCCS[M+Na]+144.632859911
AllCCS[M-H]-140.632859911
AllCCS[M+Na-2H]-140.332859911
AllCCS[M+HCOO]-140.032859911

Predicted Kovats Retention Indices

Underivatized

MetaboliteSMILESKovats RI ValueColumn TypeReference
PhenazineC1=CC2=NC3=CC=CC=C3N=C2C=C12505.1Standard polar33892256
PhenazineC1=CC2=NC3=CC=CC=C3N=C2C=C11660.0Standard non polar33892256
PhenazineC1=CC2=NC3=CC=CC=C3N=C2C=C11796.8Semi standard non polar33892256
Spectra

GC-MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted GC-MSPredicted GC-MS Spectrum - Phenazine GC-MS (Non-derivatized) - 70eV, Positivesplash10-001i-0900000000-b92c8bb02ada57d9eae72021-09-23Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Phenazine GC-MS (Non-derivatized) - 70eV, PositiveNot Available2021-10-12Wishart LabView Spectrum

MS/MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Experimental LC-MS/MSLC-MS/MS Spectrum - Phenazine 25V, Positive-QTOFsplash10-001i-0900000000-aee365d959efa995f5fd2021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Phenazine 40V, Positive-QTOFsplash10-001j-4900000000-30ab9f5030fd52f58fd72021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Phenazine 10V, Positive-QTOFsplash10-001i-0900000000-e51211b9d9dc5116810c2021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Phenazine 20V, Positive-QTOFsplash10-001i-0900000000-719f5241c1cbb4699a382021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Phenazine 150V, Positive-QTOFsplash10-0059-4900000000-61df938af67edd623ace2021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Phenazine 120V, Positive-QTOFsplash10-001i-3900000000-06c1c3e5d98d8827563e2021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Phenazine 105V, Positive-QTOFsplash10-001i-1900000000-2fbebe8fb6d9b5d8ca782021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Phenazine 45V, Positive-QTOFsplash10-001i-0900000000-fd39313308f5c76c803e2021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Phenazine 55V, Positive-QTOFsplash10-0udr-4900000000-0980aa78a18136d16ac52021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Phenazine 60V, Positive-QTOFsplash10-001i-0900000000-04ad9ff8a3e51b2df5802021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Phenazine 35V, Positive-QTOFsplash10-001i-0900000000-e090efe0cddbe7929cb22021-09-20HMDB team, MONAView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Phenazine 10V, Positive-QTOFsplash10-001i-0900000000-34bf8311168f92d0bca82016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Phenazine 20V, Positive-QTOFsplash10-001i-0900000000-34bf8311168f92d0bca82016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Phenazine 40V, Positive-QTOFsplash10-001i-2900000000-1ddcf2e78ae8e562693f2016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Phenazine 10V, Negative-QTOFsplash10-004i-0900000000-6a686a347b5c0c211c152016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Phenazine 20V, Negative-QTOFsplash10-004i-0900000000-6a686a347b5c0c211c152016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Phenazine 40V, Negative-QTOFsplash10-004i-0900000000-286bcd402503bcffc5c62016-08-03Wishart LabView Spectrum
Biological Properties
Cellular LocationsNot Available
Biospecimen Locations
  • Blood
Tissue LocationsNot Available
Pathways
Normal Concentrations
BiospecimenStatusValueAgeSexConditionReferenceDetails
BloodDetected but not QuantifiedNot QuantifiedNot SpecifiedNot SpecifiedNormal details
Abnormal Concentrations
Not Available
Associated Disorders and Diseases
Disease ReferencesNone
Associated OMIM IDsNone
DrugBank IDNot Available
Phenol Explorer Compound IDNot Available
FooDB IDNot Available
KNApSAcK IDC00015085
Chemspider ID4593
KEGG Compound IDNot Available
BioCyc IDCPD-12873
BiGG IDNot Available
Wikipedia LinkPhenazine
METLIN IDNot Available
PubChem CompoundNot Available
PDB IDNot Available
ChEBI ID36674
Food Biomarker OntologyNot Available
VMH IDNot Available
MarkerDB IDNot Available
Good Scents IDNot Available
References
Synthesis ReferenceNot Available
Material Safety Data Sheet (MSDS)Not Available
General References
  1. Barupal DK, Fiehn O: Generating the Blood Exposome Database Using a Comprehensive Text Mining and Database Fusion Approach. Environ Health Perspect. 2019 Sep;127(9):97008. doi: 10.1289/EHP4713. Epub 2019 Sep 26. [PubMed:31557052 ]