Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 1Ingredient: 1Target: 2Links: 3
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 5181
- Core Entity Id
- 8946
- Source Entity Count
- 1
- Preferred Name
- 3-pyridol
- Name En
- Pubchem Id
- 7971
- Smiles Canonical
- C1=CC(=CN=C1)O
- Molecular Formula
- C5H5NO
- Molecular Weight
- 95.1010
- Inchikey
- GRFNBEZIAWKNCO-UHFFFAOYSA-N
- Inchi
- InChI=1S/C5H5NO/c7-5-2-1-3-6-4-5/h1-4,7H
- Isomeric Smiles
- C1=CC(=CN=C1)O
- Cas Id
- 109-00-2
- Ob Score
- 37.0670
- Mol Logp
- 0.7872
- Num H Donors
- 1
- Num H Acceptors
- 2
- Num Rotatable Bonds
- 0
- Drug Likeness
- 0.5160
- Polar Surface Area
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
3-Pyridol
Role
preferred
Source
TCMBank
Preferred
Yes
Name
3-Pyridol
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
3-pyridol
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
3-pyridol
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
109-00-2
Role
alias
Source
itcmdb_public
Preferred
No
Name
109-00-2
Role
alias
Source
TCMBank
Preferred
No
Name
109-00-2
Role
alias
Source
HERB_v2
Preferred
No
Name
3-HYDROXYPYRIDINE
Role
alias
Source
itcmdb_public
Preferred
No
Name
3-HYDROXYPYRIDINE
Role
alias
Source
HERB_v2
Preferred
No
Name
3-Hydroxypyridine
Role
alias
Source
TCMBank
Preferred
No
Name
3-Oxopyridine
Role
alias
Source
itcmdb_public
Preferred
No
Name
3-Oxopyridine
Role
alias
Source
HERB_v2
Preferred
No
Name
3-Oxopyridine
Role
alias
Source
TCMBank
Preferred
No
Name
3-Pyridinol
Role
alias
Source
itcmdb_public
Preferred
No
Name
3-Pyridinol
Role
alias
Source
TCMBank
Preferred
No
Name
3-Pyridinol
Role
alias
Source
HERB_v2
Preferred
No
Name
3-Pyridone
Role
alias
Source
itcmdb_public
Preferred
No
Name
3-Pyridone
Role
alias
Source
HERB_v2
Preferred
No
Name
3-Pyridone
Role
alias
Source
TCMBank
Preferred
No
Name
3-Pyridyl alcohol
Role
alias
Source
itcmdb_public
Preferred
No
Name
3-Pyridyl alcohol
Role
alias
Source
HERB_v2
Preferred
No
Name
3-Pyridyl alcohol
Role
alias
Source
TCMBank
Preferred
No
Name
AC-907/25014060
Role
alias
Source
TCMBank
Preferred
No
Name
AI3-19237
Role
alias
Source
TCMBank
Preferred
No
Name
AIDS-020387
Role
alias
Source
TCMBank
Preferred
No
Name
EINECS 203-637-4
Role
alias
Source
TCMBank
Preferred
No
Name
H57009_ALDRICH
Role
alias
Source
TCMBank
Preferred
No
Name
InChI=1/C5H5NO/c7-5-2-1-3-6-4-5/h1-4,7
Role
alias
Source
TCMBank
Preferred
No
Name
NSC 18470
Role
alias
Source
TCMBank
Preferred
No
Name
SBB004391
Role
alias
Source
TCMBank
Preferred
No
Name
ZINC00967325
Role
alias
Source
TCMBank
Preferred
No
Name
beta-Hydroxypyridine
Role
alias
Source
HERB_v2
Preferred
No
Name
beta-Hydroxypyridine
Role
alias
Source
TCMBank
Preferred
No
Name
beta-Hydroxypyridine
Role
alias
Source
itcmdb_public
Preferred
No
Name
m-Hydroxypyridine
Role
alias
Source
HERB_v2
Preferred
No
Name
m-Hydroxypyridine
Role
alias
Source
TCMBank
Preferred
No
Name
m-Hydroxypyridine
Role
alias
Source
itcmdb_public
Preferred
No
Name
pyridin-3-ol
Role
alias
Source
HERB_v2
Preferred
No
Name
pyridin-3-ol
Role
alias
Source
TCMBank
Preferred
No
Name
pyridin-3-ol
Role
alias
Source
itcmdb_public
Preferred
No
Aliases
Additional names normalized into the restored final schema.
109-00-23-HYDROXYPYRIDINE3-Oxopyridine3-Pyridinol3-Pyridone3-Pyridyl alcoholAC-907/25014060AI3-19237AIDS-020387EINECS 203-637-4H57009_ALDRICHInChI=1/C5H5NO/c7-5-2-1-3-6-4-5/h1-4,7NSC 18470SBB004391ZINC00967325beta-Hydroxypyridinem-Hydroxypyridinepyridin-3-ol
Cross References
Trusted external identifiers retained for this final record.
Cas
109-00-2
Herb
HBIN009481
Npass
NPC174421
Tcmsp
MOL010219
Sym Map
SMIT11281
Pub Chem
7971
Tcmbank
TCMBANKIN021443
Attributes
Merged source attributes and domain-specific metadata.
Type
Other ingredients
In Ch I
InChI=1S/C5H5NO/c7-5-2-1-3-6-4-5/h1-4,7H
Mol Wt
95.10099999999997
Cas Id
109-00-2
Smiles
C1=CC(=CN=C1)O
Mol Log P
0.7871999999999997
Version
v1,v2
In Ch Ikey
GRFNBEZIAWKNCO-UHFFFAOYSA-N
Ob Score
37.06737.0672186637.067219
Suppress
0
Num Hdonors
1
Drug Likeness
0.516
Num Hacceptors
2
Isomeric Smiles
C1=CC(=CN=C1)O
Molecule Weight
95.11
Canonical Smiles
C1=CC(=CN=C1)O
Herb Alias Names
3-HYDROXYPYRIDINEpyridin-3-ol109-00-23-Pyridinol3-Pyridone3-Oxopyridinebeta-Hydroxypyridinem-Hydroxypyridine3-Pyridyl alcohol
Molecular Weight
95.1
Molecular Formula
C5H5NO
Molecular Formula
C5H5NO
Num Rotatable Bonds
0