Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 4Ingredient: 1Links: 4
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 17533
- Core Entity Id
- 22659
- Source Entity Count
- 1
- Preferred Name
- Dolomite
- Name En
- Pubchem Id
- 61833
- Smiles Canonical
- C(=O)([O-])[O-].C(=O)([O-])[O-].[Mg+2].[Ca+2]
- Molecular Formula
- C2CaMgO6
- Molecular Weight
- 184.3990
- Inchikey
- HHSPVTKDOHQBKF-UHFFFAOYSA-J
- Inchi
- InChI=1S/2CH2O3.Ca.Mg/c2*2-1(3)4;;/h2*(H2,2,3,4);;/q;;2*+2/p-4
- Isomeric Smiles
- C(=O)([O-])[O-].C(=O)([O-])[O-].[Mg+2].[Ca+2]
- Cas Id
- Ob Score
- Mol Logp
- -5.6556
- Num H Donors
- 0
- Num H Acceptors
- 6
- Num Rotatable Bonds
- 0
- Drug Likeness
- 0.3450
- Polar Surface Area
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Dolomite
Role
Molecule_name
Source
SymMap_v2
Preferred
Yes
Name
Dolomite
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
Dolomite
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
Dolomite
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
dolomite
Role
preferred
Source
TCMBank
Preferred
Yes
Name
12001-27-3
Role
alias
Source
itcmdb_public
Preferred
No
Name
12001-27-3
Role
alias
Source
HERB_v2
Preferred
No
Name
16389-88-1
Role
alias
Source
HERB_v2
Preferred
No
Name
16389-88-1
Role
alias
Source
itcmdb_public
Preferred
No
Name
Calcidol
Role
alias
Source
itcmdb_public
Preferred
No
Name
Calcidol
Role
alias
Source
HERB_v2
Preferred
No
Name
Calcium magnesium dicarbonate
Role
alias
Source
itcmdb_public
Preferred
No
Name
Calcium magnesium dicarbonate
Role
alias
Source
HERB_v2
Preferred
No
Name
Dolomite (CaMg(CO3)2)
Role
alias
Source
itcmdb_public
Preferred
No
Name
Dolomite (CaMg(CO3)2)
Role
alias
Source
HERB_v2
Preferred
No
Name
Dolomitic lime
Role
alias
Source
HERB_v2
Preferred
No
Name
Dolomitic lime
Role
alias
Source
itcmdb_public
Preferred
No
Name
Uwanuriyo
Role
alias
Source
itcmdb_public
Preferred
No
Name
Uwanuriyo
Role
alias
Source
HERB_v2
Preferred
No
Name
Virpazar
Role
alias
Source
HERB_v2
Preferred
No
Name
Virpazar
Role
alias
Source
itcmdb_public
Preferred
No
Name
calcium magnesium carbonate
Role
alias
Source
itcmdb_public
Preferred
No
Name
calcium magnesium carbonate
Role
alias
Source
HERB_v2
Preferred
No
Aliases
Additional names normalized into the restored final schema.
12001-27-316389-88-1CalcidolCalcium magnesium dicarbonateDolomite (CaMg(CO3)2)Dolomitic limeUwanuriyoVirpazarcalcium magnesium carbonate
Cross References
Trusted external identifiers retained for this final record.
Herb
HBIN024404
Tcmid
37300
Sym Map
SMIT23665
Pub Chem
61833
Tcmbank
TCMBANKIN035479
Itcmdb Generated
ITX-INGREDIENT-5EEE8F98E259
Attributes
Merged source attributes and domain-specific metadata.
Type
Other ingredients
In Ch I
InChI=1S/2CH2O3.Ca.Mg/c2*2-1(3)4;;/h2*(H2,2,3,4);;/q;;2*+2/p-4
Mol Wt
184.399
Smiles
C(=O)([O-])[O-].C(=O)([O-])[O-].[Mg+2].[Ca+2]
Mol Log P
-5.6556
Version
v2
In Ch Ikey
HHSPVTKDOHQBKF-UHFFFAOYSA-J
Suppress
0
Num Hdonors
0
Drug Likeness
0.345
Num Hacceptors
6
Isomeric Smiles
C(=O)([O-])[O-].C(=O)([O-])[O-].[Mg+2].[Ca+2]
Canonical Smiles
C(=O)([O-])[O-].C(=O)([O-])[O-].[Mg+2].[Ca+2]
Herb Alias Names
Calcium magnesium dicarbonateDolomitic limeCalcidol16389-88-1calcium magnesium carbonateDolomite (CaMg(CO3)2)12001-27-3UwanuriyoVirpazar
Molecular Formula
C2CaMgO6
Molecular Formula
C2CaMgO6
Num Rotatable Bonds
0