Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 1Ingredient: 1Target: 12Links: 13
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 2112
- Core Entity Id
- 5537
- Source Entity Count
- 1
- Preferred Name
- 2-methoxy-naphthalene
- Name En
- Pubchem Id
- 7119
- Smiles Canonical
- COC1=CC2=CC=CC=C2C=C1
- Molecular Formula
- C11H10O
- Molecular Weight
- 158.2000
- Inchikey
- LUZDYPLAQQGJEA-UHFFFAOYSA-N
- Inchi
- InChI=1S/C11H10O/c1-12-11-7-6-9-4-2-3-5-10(9)8-11/h2-8H,1H3
- Isomeric Smiles
- COC1=CC2=CC=CC=C2C=C1
- Cas Id
- Ob Score
- Mol Logp
- 2.8484
- Num H Donors
- 0
- Num H Acceptors
- 1
- Num Rotatable Bonds
- 1
- Drug Likeness
- 0.6200
- Polar Surface Area
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
2-Methoxy-Naphthalene
Role
Molecule_name
Source
SymMap_v2
Preferred
Yes
Name
2-Methoxy-Naphthalene
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
2-methoxy-naphthalene
Role
preferred
Source
TCMBank
Preferred
Yes
Name
2-methoxy-naphthalene
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
2-methoxy-naphthalene
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
2-METHOXYNAPHTHALENE
Role
alias
Source
HERB_v2
Preferred
No
Name
2-METHOXYNAPHTHALENE
Role
alias
Source
itcmdb_public
Preferred
No
Name
2-Naphthol methyl ether
Role
alias
Source
itcmdb_public
Preferred
No
Name
2-Naphthol methyl ether
Role
alias
Source
HERB_v2
Preferred
No
Name
2-Naphthyl methyl ether
Role
alias
Source
itcmdb_public
Preferred
No
Name
2-Naphthyl methyl ether
Role
alias
Source
HERB_v2
Preferred
No
Name
93-04-9
Role
alias
Source
itcmdb_public
Preferred
No
Name
93-04-9
Role
alias
Source
HERB_v2
Preferred
No
Name
Methyl 2-naphthyl ether
Role
alias
Source
HERB_v2
Preferred
No
Name
Methyl 2-naphthyl ether
Role
alias
Source
itcmdb_public
Preferred
No
Name
Naphthalene, 2-methoxy-
Role
alias
Source
HERB_v2
Preferred
No
Name
Naphthalene, 2-methoxy-
Role
alias
Source
itcmdb_public
Preferred
No
Name
Nerolin
Role
alias
Source
HERB_v2
Preferred
No
Name
Nerolin
Role
alias
Source
itcmdb_public
Preferred
No
Name
Yara yara
Role
alias
Source
HERB_v2
Preferred
No
Name
Yara-Yara
Role
alias
Source
itcmdb_public
Preferred
No
Name
Yura yara
Role
alias
Source
HERB_v2
Preferred
No
Name
Yura yara
Role
alias
Source
itcmdb_public
Preferred
No
Aliases
Additional names normalized into the restored final schema.
2-METHOXYNAPHTHALENE2-Naphthol methyl ether2-Naphthyl methyl ether93-04-9Methyl 2-naphthyl etherNaphthalene, 2-methoxy-NerolinYara yaraYara-YaraYura yara
Cross References
Trusted external identifiers retained for this final record.
Herb
HBIN005919
Npass
NPC241224
Tcmid
33542
Sym Map
SMIT20662
Pub Chem
7119
Tcmbank
TCMBANKIN014981
Itcmdb Generated
ITX-INGREDIENT-D6785EC89CE4
Attributes
Merged source attributes and domain-specific metadata.
Type
Other ingredients
In Ch I
InChI=1S/C11H10O/c1-12-11-7-6-9-4-2-3-5-10(9)8-11/h2-8H,1H3
Mol Wt
158.2
Smiles
COC1=CC2=CC=CC=C2C=C1
Mol Log P
2.848400000000001
Version
v2
In Ch Ikey
LUZDYPLAQQGJEA-UHFFFAOYSA-N
Suppress
0
Num Hdonors
0
Drug Likeness
0.62
Num Hacceptors
1
Isomeric Smiles
COC1=CC2=CC=CC=C2C=C1
Canonical Smiles
COC1=CC2=CC=CC=C2C=C1
Herb Alias Names
2-METHOXYNAPHTHALENE93-04-9Naphthalene, 2-methoxy-NerolinYara yaraMethyl 2-naphthyl etherYura yaraYara-Yara2-Naphthol methyl ether2-Naphthyl methyl ether
Molecular Weight
158.2 g/mol
Molecular Formula
C11H10O
Molecular Formula
C11H10O
Num Rotatable Bonds
1