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: 3Ingredient: 1Target: 3Links: 6
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 27880
- Core Entity Id
- 34174
- Source Entity Count
- 1
- Preferred Name
- Norbornane
- Name En
- Pubchem Id
- 9233
- Smiles Canonical
- C1CC2CCC1C2
- Molecular Formula
- C7H12
- Molecular Weight
- 96.1730
- Inchikey
- UMRZSTCPUPJPOJ-UHFFFAOYSA-N
- Inchi
- InChI=1S/C7H12/c1-2-7-4-3-6(1)5-7/h6-7H,1-5H2
- Isomeric Smiles
- C1CC2CCC1C2
- Cas Id
- 279-23-2
- Ob Score
- 48.4898
- Mol Logp
- 2.1965
- Num H Donors
- 0
- Num H Acceptors
- 0
- Num Rotatable Bonds
- 0
- Drug Likeness
- 0.4330
- Polar Surface Area
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Norbornane
Role
Molecule_name
Source
SymMap_v2
Preferred
Yes
Name
NORBORNANE
Role
preferred
Source
TCMBank
Preferred
Yes
Name
NORBORNANE
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
Norbornane
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
Norbornane
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
Norbornane
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
1,4-Endomethylenecyclohexane
Role
alias
Source
HERB_v2
Preferred
No
Name
1,4-Endomethylenecyclohexane
Role
alias
Source
itcmdb_public
Preferred
No
Name
279-23-2
Role
alias
Source
itcmdb_public
Preferred
No
Name
279-23-2
Role
alias
Source
HERB_v2
Preferred
No
Name
Bicyclo[2.2.1]heptane
Role
alias
Source
itcmdb_public
Preferred
No
Name
Bicyclo[2.2.1]heptane
Role
alias
Source
HERB_v2
Preferred
No
Name
Cyclohexane, 1,4-endo-methylene-
Role
alias
Source
HERB_v2
Preferred
No
Name
Cyclohexane, 1,4-endo-methylene-
Role
alias
Source
itcmdb_public
Preferred
No
Name
Norbornylane
Role
alias
Source
HERB_v2
Preferred
No
Name
Norbornylane
Role
alias
Source
itcmdb_public
Preferred
No
Name
Norcamphane
Role
alias
Source
itcmdb_public
Preferred
No
Name
Norcamphane
Role
alias
Source
HERB_v2
Preferred
No
Name
Norfenchane
Role
alias
Source
HERB_v2
Preferred
No
Name
Norfenchane
Role
alias
Source
itcmdb_public
Preferred
No
Name
Norsantane
Role
alias
Source
HERB_v2
Preferred
No
Name
Norsantane
Role
alias
Source
itcmdb_public
Preferred
No
Aliases
Additional names normalized into the restored final schema.
1,4-Endomethylenecyclohexane279-23-2Bicyclo[2.2.1]heptaneCyclohexane, 1,4-endo-methylene-NorbornylaneNorcamphaneNorfenchaneNorsantane
Cross References
Trusted external identifiers retained for this final record.
Cas
279-23-2
Herb
HBIN037303
Tcmsp
MOL013106
Sym Map
SMIT13803
Pub Chem
9233
Tcmbank
TCMBANKIN003341
Etcm Ingredient
NORBORNANE
Itcmdb Generated
ITX-INGREDIENT-01FBFDA00869
Attributes
Merged source attributes and domain-specific metadata.
Type
Other ingredients
In Ch I
InChI=1S/C7H12/c1-2-7-4-3-6(1)5-7/h6-7H,1-5H2
Mol Wt
96.173
Cas Id
279-23-2
Smiles
C1CC2CCC1C2
Mol Log P
2.1965
Version
v1,v2
In Ch Ikey
UMRZSTCPUPJPOJ-UHFFFAOYSA-N
Ob Score
48.48975648.4897561448.49
Suppress
0
Num Hdonors
0
Drug Likeness
0.433
Num Hacceptors
0
Isomeric Smiles
C1CC2CCC1C2
Molecule Weight
96.19
Canonical Smiles
C1CC2CCC1C2
Herb Alias Names
Bicyclo[2.2.1]heptane279-23-2NorbornylaneNorcamphaneNorfenchaneNorsantane1,4-EndomethylenecyclohexaneBicyclo(2.2.1)heptaneCyclohexane, 1,4-endo-methylene-
Molecular Weight
96.090
Molecular Weight
96.17
Molecular Formula
C7H12
Molecular Formula
C7H12
Molecular Formula
C7H12
Num Rotatable Bonds
0
Fda Maximum Daily Dose (Fdamdd)
0.053
Quantitative Estimate Of Drug Likeness（Qed）
0.433