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
- 2033
- Core Entity Id
- 5449
- Source Entity Count
- 1
- Preferred Name
- 2-hydroxyphenylethanol
- Name En
- Pubchem Id
- 82200
- Smiles Canonical
- C1=CC=C(C(=C1)CCO)O
- Molecular Formula
- C8H10O2
- Molecular Weight
- 138.1660
- Inchikey
- ABFCOJLLBHXNOU-UHFFFAOYSA-N
- Inchi
- InChI=1S/C8H10O2/c9-6-5-7-3-1-2-4-8(7)10/h1-4,9-10H,5-6H2
- Isomeric Smiles
- C1=CC=C(C(=C1)CCO)O
- Cas Id
- 7768-28-7
- Ob Score
- 50.3698
- Mol Logp
- 0.9270
- Num H Donors
- 2
- Num H Acceptors
- 2
- Num Rotatable Bonds
- 2
- Drug Likeness
- 0.6380
- Polar Surface Area
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
2-Hydroxyphenylethanol
Role
Molecule_name
Source
SymMap_v2
Preferred
Yes
Name
2-Hydroxyphenylethanol
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
2-Hydroxyphenylethanol
Role
preferred
Source
TCMBank
Preferred
Yes
Name
2-Hydroxyphenylethanol
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
2-hydroxyphenylethanol
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
2-hydroxyphenylethanol
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
188247_ALDRICH
Role
alias
Source
TCMBank
Preferred
No
Name
2-(2-Hydroxyethyl)phenol
Role
alias
Source
itcmdb_public
Preferred
No
Name
2-(2-Hydroxyethyl)phenol
Role
alias
Source
HERB_v2
Preferred
No
Name
2-(2-Hydroxyphenyl)ethanol
Role
alias
Source
itcmdb_public
Preferred
No
Name
2-(2-Hydroxyphenyl)ethanol
Role
alias
Source
HERB_v2
Preferred
No
Name
2-(2-hydroxyethyl)phenol
Role
alias
Source
TCMBank
Preferred
No
Name
2-(o-Hydroxyphenyl)ethanol
Role
alias
Source
itcmdb_public
Preferred
No
Name
2-(o-Hydroxyphenyl)ethanol
Role
alias
Source
HERB_v2
Preferred
No
Name
2-Hydroxybenzeneethanol
Role
alias
Source
itcmdb_public
Preferred
No
Name
2-Hydroxybenzeneethanol
Role
alias
Source
HERB_v2
Preferred
No
Name
2-Hydroxyphenethyl alcohol
Role
alias
Source
TCMBank
Preferred
No
Name
2-Hydroxyphenethyl alcohol
Role
alias
Source
itcmdb_public
Preferred
No
Name
2-Hydroxyphenethyl alcohol
Role
alias
Source
HERB_v2
Preferred
No
Name
7768-28-7
Role
alias
Source
HERB_v2
Preferred
No
Name
7768-28-7
Role
alias
Source
TCMBank
Preferred
No
Name
7768-28-7
Role
alias
Source
itcmdb_public
Preferred
No
Name
Benzeneethanol, 2-hydroxy-
Role
alias
Source
HERB_v2
Preferred
No
Name
Benzeneethanol, 2-hydroxy-
Role
alias
Source
itcmdb_public
Preferred
No
Name
EINECS 231-863-3
Role
alias
Source
TCMBank
Preferred
No
Name
InChI=1/C8H10O2/c9-6-5-7-3-1-2-4-8(7)10/h1-4,9-10H,5-6H
Role
alias
Source
TCMBank
Preferred
No
Name
NSC 101845
Role
alias
Source
TCMBank
Preferred
No
Name
ZINC00406927
Role
alias
Source
TCMBank
Preferred
No
Name
benzeneethanol, 2-hydroxy-
Role
alias
Source
TCMBank
Preferred
No
Name
o-(2-Hydroxyethyl)phenol
Role
alias
Source
HERB_v2
Preferred
No
Name
o-(2-Hydroxyethyl)phenol
Role
alias
Source
TCMBank
Preferred
No
Name
o-(2-Hydroxyethyl)phenol
Role
alias
Source
itcmdb_public
Preferred
No
Name
o-Hydroxyphenethyl alcohol
Role
alias
Source
HERB_v2
Preferred
No
Name
o-Hydroxyphenethyl alcohol
Role
alias
Source
itcmdb_public
Preferred
No
Aliases
Additional names normalized into the restored final schema.
188247_ALDRICH2-(2-Hydroxyethyl)phenol2-(2-Hydroxyphenyl)ethanol2-(o-Hydroxyphenyl)ethanol2-Hydroxybenzeneethanol2-Hydroxyphenethyl alcohol7768-28-7Benzeneethanol, 2-hydroxy-EINECS 231-863-3InChI=1/C8H10O2/c9-6-5-7-3-1-2-4-8(7)10/h1-4,9-10H,5-6HNSC 101845ZINC00406927o-(2-Hydroxyethyl)phenolo-Hydroxyphenethyl alcohol
Cross References
Trusted external identifiers retained for this final record.
Cas
7768-28-7
Herb
HBIN005822
Tcmsp
MOL006082
Sym Map
SMIT07758
Pub Chem
82200
Tcmbank
TCMBANKIN036666
Etcm Ingredient
2-Hydroxyphenylethanol
Itcmdb Generated
ITX-INGREDIENT-E2F10CBC665B
Attributes
Merged source attributes and domain-specific metadata.
Type
Other ingredients
In Ch I
InChI=1S/C8H10O2/c9-6-5-7-3-1-2-4-8(7)10/h1-4,9-10H,5-6H2
Mol Wt
138.166
Cas Id
7768-28-7
Smiles
C1=CC=C(C(=C1)CCO)O
Mol Log P
0.9269999999999996
Version
v1,v2
In Ch Ikey
ABFCOJLLBHXNOU-UHFFFAOYSA-N
Ob Score
50.3697737450.36977450.37
Suppress
0
Num Hdonors
2
Drug Likeness
0.638
Num Hacceptors
2
Isomeric Smiles
C1=CC=C(C(=C1)CCO)O
Molecule Weight
138.18
Canonical Smiles
C1=CC=C(C(=C1)CCO)O
Herb Alias Names
2-Hydroxyphenethyl alcohol2-(2-Hydroxyethyl)phenol7768-28-72-(2-Hydroxyphenyl)ethanol2-HydroxybenzeneethanolBenzeneethanol, 2-hydroxy-o-(2-Hydroxyethyl)phenolo-Hydroxyphenethyl alcohol2-(o-Hydroxyphenyl)ethanol
Molecular Weight
138.070
Molecular Weight
138.16
Molecular Formula
C8H10O2
Molecular Formula
C8H10O2
Molecular Formula
C8H10O2
Num Rotatable Bonds
2
Fda Maximum Daily Dose (Fdamdd)
0.011
Quantitative Estimate Of Drug Likeness（Qed）
0.638