Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 1Ingredient: 1Links: 1
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 5590
- Core Entity Id
- 9404
- Source Entity Count
- 1
- Preferred Name
- 4-[(4-hydroxyphenyl)methoxy]benzenemethanol
- Name En
- Pubchem Id
- 5318319
- Smiles Canonical
- C1=CC(=CC=C1CO)OCC2=CC=C(C=C2)O
- Molecular Formula
- C14H14O3
- Molecular Weight
- 230.2630
- Inchikey
- HCAYDPXMXLXVCV-UHFFFAOYSA-N
- Inchi
- InChI=1S/C14H14O3/c15-9-11-3-7-14(8-4-11)17-10-12-1-5-13(16)6-2-12/h1-8,15-16H,9-10H2
- Isomeric Smiles
- C1=CC(=CC=C1CO)OCC2=CC=C(C=C2)O
- Cas Id
- Ob Score
- Mol Logp
- 2.4635
- Num H Donors
- 2
- Num H Acceptors
- 3
- Num Rotatable Bonds
- 4
- Drug Likeness
- 0.8480
- Polar Surface Area
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
4-[(4-hydroxyphenyl)methoxy]benzenemethanol
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
4-[(4-hydroxyphenyl)methoxy]benzenemethanol
Role
preferred
Source
TCMBank
Preferred
Yes
Name
4-[(4-hydroxyphenyl)methoxy]benzenemethanol
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
凹舌兰
Role
TCM_name
Source
TCMBank
Preferred
No
Name
AO SHE LAN
Role
TCM_name2
Source
TCMBank
Preferred
No
Name
Frog Orchid
Role
TCM_name_en
Source
TCMBank
Preferred
No
Name
AKOS017341557
Role
alias
Source
HERB_v2
Preferred
No
Name
AKOS017341557
Role
alias
Source
itcmdb_public
Preferred
No
Aliases
Additional names normalized into the restored final schema.
凹舌兰AO SHE LANFrog OrchidAKOS017341557
Cross References
Trusted external identifiers retained for this final record.
Herb
HBIN009963
Npass
NPC147622
Tcmid
10626
Pub Chem
5318319
Tcmbank
TCMBANKIN049659
Attributes
Merged source attributes and domain-specific metadata.
In Ch I
InChI=1S/C14H14O3/c15-9-11-3-7-14(8-4-11)17-10-12-1-5-13(16)6-2-12/h1-8,15-16H,9-10H2
Mol Wt
230.263
Mol Log P
2.4635
In Ch Ikey
HCAYDPXMXLXVCV-UHFFFAOYSA-N
Tcm Name
凹舌兰
Tcm Name2
AO SHE LAN
Mol2 Path
/TCM_database/2007_3d_all/10627.mol2
Reference
2248
Num Hdonors
2
Tcm Name En
Frog Orchid
Drug Likeness
0.848
Num Hacceptors
3
Isomeric Smiles
C1=CC(=CC=C1CO)OCC2=CC=C(C=C2)O
Canonical Smiles
C1=CC(=CC=C1CO)OCC2=CC=C(C=C2)O
Herb Alias Names
AKOS017341557
Molecular Formula
C14H14O3
Num Rotatable Bonds
4