Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 1Ingredient: 1Target: 11Links: 12
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 6115
- Core Entity Id
- 9980
- Source Entity Count
- 1
- Preferred Name
- 4'-hydroxy-propiophenone
- Name En
- Pubchem Id
- 6271
- Smiles Canonical
- CCC(=O)C1=CC=C(C=C1)O
- Molecular Formula
- C9H10O2
- Molecular Weight
- 150.1770
- Inchikey
- RARSHUDCJQSEFJ-UHFFFAOYSA-N
- Inchi
- InChI=1S/C9H10O2/c1-2-9(11)7-3-5-8(10)6-4-7/h3-6,10H,2H2,1H3
- Isomeric Smiles
- CCC(=O)C1=CC=C(C=C1)O
- Cas Id
- Ob Score
- Mol Logp
- 1.9849
- Num H Donors
- 1
- Num H Acceptors
- 2
- Num Rotatable Bonds
- 2
- Drug Likeness
- 0.6540
- Polar Surface Area
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
4'-Hydroxy-Propiophenone
Role
Molecule_name
Source
SymMap_v2
Preferred
Yes
Name
4'-Hydroxy-Propiophenone
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
4'-hydroxy-propiophenone
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
4'-hydroxy-propiophenone
Role
preferred
Source
TCMBank
Preferred
Yes
Name
4'-hydroxy-propiophenone
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
1-(4-hydroxyphenyl)propan-1-one
Role
alias
Source
HERB_v2
Preferred
No
Name
1-(4-hydroxyphenyl)propan-1-one
Role
alias
Source
itcmdb_public
Preferred
No
Name
4'-Hydroxypropiophenone
Role
alias
Source
HERB_v2
Preferred
No
Name
4-Hydroxypropiophenone
Role
alias
Source
itcmdb_public
Preferred
No
Name
70-70-2
Role
alias
Source
itcmdb_public
Preferred
No
Name
70-70-2
Role
alias
Source
HERB_v2
Preferred
No
Name
Frenantol
Role
alias
Source
itcmdb_public
Preferred
No
Name
Frenantol
Role
alias
Source
HERB_v2
Preferred
No
Name
Frenohypon
Role
alias
Source
HERB_v2
Preferred
No
Name
Frenohypon
Role
alias
Source
itcmdb_public
Preferred
No
Name
Mepal
Role
alias
Source
HERB_v2
Preferred
No
Name
Mepal
Role
alias
Source
itcmdb_public
Preferred
No
Name
Paroxypropion
Role
alias
Source
HERB_v2
Preferred
No
Name
Paroxypropion
Role
alias
Source
itcmdb_public
Preferred
No
Name
Paroxypropione
Role
alias
Source
itcmdb_public
Preferred
No
Name
Paroxypropione
Role
alias
Source
HERB_v2
Preferred
No
Name
p-Hydroxypropiophenone
Role
alias
Source
itcmdb_public
Preferred
No
Name
p-Hydroxypropiophenone
Role
alias
Source
HERB_v2
Preferred
No
Aliases
Additional names normalized into the restored final schema.
1-(4-hydroxyphenyl)propan-1-one4'-Hydroxypropiophenone4-Hydroxypropiophenone70-70-2FrenantolFrenohyponMepalParoxypropionParoxypropionep-Hydroxypropiophenone
Cross References
Trusted external identifiers retained for this final record.
Hit
C0293
Herb
HBIN010570
Npass
NPC226699
Tcmid
36255
Sym Map
SMIT21408
Pub Chem
6271
Tcmbank
TCMBANKIN012313
Itcmdb Generated
ITX-INGREDIENT-EDAFB56E3F7B
Attributes
Merged source attributes and domain-specific metadata.
Type
Other ingredients
In Ch I
InChI=1S/C9H10O2/c1-2-9(11)7-3-5-8(10)6-4-7/h3-6,10H,2H2,1H3
Mol Wt
150.177
Smiles
CCC(=O)C1=CC=C(C=C1)O
Mol Log P
1.9849
Version
v2
In Ch Ikey
RARSHUDCJQSEFJ-UHFFFAOYSA-N
Suppress
0
Num Hdonors
1
Drug Likeness
0.654
Num Hacceptors
2
Isomeric Smiles
CCC(=O)C1=CC=C(C=C1)O
Canonical Smiles
CCC(=O)C1=CC=C(C=C1)O
Herb Alias Names
4'-Hydroxypropiophenone70-70-2Paroxypropione4-Hydroxypropiophenone1-(4-hydroxyphenyl)propan-1-onep-HydroxypropiophenoneMepalParoxypropionFrenantolFrenohypon
Molecular Weight
150.17 g/mol
Molecular Formula
C9H10O2
Molecular Formula
C9H10O2
Num Rotatable Bonds
2