Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
Click a node to open it in a new tab
Herb: 10Ingredient: 1Meta-analysis: 1Target: 10Links: 21
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 12039
- Core Entity Id
- 16549
- Source Entity Count
- 1
- Preferred Name
- Barium
- Name En
- Pubchem Id
- 5355457
- Smiles Canonical
- [Ba]
- Molecular Formula
- Ba
- Molecular Weight
- 137.3280
- Inchikey
- DSAJWYNOEDNPEQ-UHFFFAOYSA-N
- Inchi
- InChI=1S/Ba
- Isomeric Smiles
- [Ba]
- Cas Id
- Ob Score
- Mol Logp
- -0.3808
- Num H Donors
- 0
- Num H Acceptors
- 0
- Num Rotatable Bonds
- 0
- Drug Likeness
- 0.3990
- Polar Surface Area
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Barium
Role
Molecule_name
Source
SymMap_v2
Preferred
Yes
Name
Barium
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
Barium
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
Barium
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
barium
Role
preferred
Source
TCMBank
Preferred
Yes
Name
24GP945V5T
Role
alias
Source
itcmdb_public
Preferred
No
Name
24GP945V5T
Role
alias
Source
HERB_v2
Preferred
No
Name
7440-39-3
Role
alias
Source
itcmdb_public
Preferred
No
Name
7440-39-3
Role
alias
Source
HERB_v2
Preferred
No
Name
Ba
Role
alias
Source
HERB_v2
Preferred
No
Name
Ba
Role
alias
Source
itcmdb_public
Preferred
No
Name
Bario
Role
alias
Source
itcmdb_public
Preferred
No
Name
Barium metal
Role
alias
Source
HERB_v2
Preferred
No
Name
Barium metal
Role
alias
Source
itcmdb_public
Preferred
No
Name
Barium, elemental
Role
alias
Source
itcmdb_public
Preferred
No
Name
Barium, elemental
Role
alias
Source
HERB_v2
Preferred
No
Name
MFCD00134031
Role
alias
Source
itcmdb_public
Preferred
No
Name
MFCD00134031
Role
alias
Source
HERB_v2
Preferred
No
Name
bario
Role
alias
Source
HERB_v2
Preferred
No
Name
baryum
Role
alias
Source
HERB_v2
Preferred
No
Name
baryum
Role
alias
Source
itcmdb_public
Preferred
No
Aliases
Additional names normalized into the restored final schema.
24GP945V5T7440-39-3BaBarioBarium metalBarium, elementalMFCD00134031baryum
Cross References
Trusted external identifiers retained for this final record.
Herb
HBIN017599
Tcmid
32904
Sym Map
SMIT22515
Pub Chem
5355457
Tcmbank
TCMBANKIN035437
Drug Bank
DB12481
Itcmdb Generated
ITX-INGREDIENT-724BAE86A97E
Attributes
Merged source attributes and domain-specific metadata.
Type
Other ingredients
In Ch I
InChI=1S/Ba
Mol Wt
137.328
Smiles
[Ba]
Mol Log P
-0.3808
Version
v2
In Ch Ikey
DSAJWYNOEDNPEQ-UHFFFAOYSA-N
Suppress
0
Num Hdonors
0
Drug Likeness
0.399
Num Hacceptors
0
Isomeric Smiles
[Ba]
Canonical Smiles
[Ba]
Herb Alias Names
7440-39-3BabariobaryumBarium, elementalBarium metalMFCD00134031BarioBaryum24GP945V5T
Molecular Weight
137.33 g/mol
Molecular Formula
Ba
Molecular Formula
Ba
Num Rotatable Bonds
0