Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 1Ingredient: 1Target: 4Links: 5
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 245
- Core Entity Id
- 2439
- Source Entity Count
- 1
- Preferred Name
- 2-(2-propenyl)phenol
- Name En
- Pubchem Id
- 15624
- Smiles Canonical
- C=CCC1=CC=CC=C1O
- Molecular Formula
- C9H10O
- Molecular Weight
- 134.1780
- Inchikey
- QIRNGVVZBINFMX-UHFFFAOYSA-N
- Inchi
- InChI=1S/C9H10O/c1-2-5-8-6-3-4-7-9(8)10/h2-4,6-7,10H,1,5H2
- Isomeric Smiles
- C=CCC1=CC=CC=C1O
- Cas Id
- Ob Score
- Mol Logp
- 2.1207
- Num H Donors
- 1
- Num H Acceptors
- 1
- Num Rotatable Bonds
- 2
- Drug Likeness
- 0.6140
- Polar Surface Area
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
2-(2-Propenyl) phenol
Role
preferred
Source
TCMBank
Preferred
Yes
Name
2-(2-propenyl)phenol
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
2-(2-propenyl)phenol
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
大良姜
Role
TCM_name
Source
TCMBank
Preferred
No
Name
DA LIANG JIANG
Role
TCM_name2
Source
TCMBank
Preferred
No
Name
Galanga Galangal
Role
TCM_name_en
Source
TCMBank
Preferred
No
Name
1745-81-9
Role
alias
Source
itcmdb_public
Preferred
No
Name
1745-81-9
Role
alias
Source
HERB_v2
Preferred
No
Name
2-(prop-2-en-1-yl)phenol
Role
alias
Source
itcmdb_public
Preferred
No
Name
2-(prop-2-en-1-yl)phenol
Role
alias
Source
HERB_v2
Preferred
No
Name
2-ALLYLPHENOL
Role
alias
Source
itcmdb_public
Preferred
No
Name
2-ALLYLPHENOL
Role
alias
Source
HERB_v2
Preferred
No
Name
2-prop-2-enylphenol
Role
alias
Source
HERB_v2
Preferred
No
Name
2-prop-2-enylphenol
Role
alias
Source
itcmdb_public
Preferred
No
Name
Phenol, (2-propenyl)-
Role
alias
Source
HERB_v2
Preferred
No
Name
Phenol, (2-propenyl)-
Role
alias
Source
itcmdb_public
Preferred
No
Name
Phenol, 2-(2-propen-1-yl)-
Role
alias
Source
HERB_v2
Preferred
No
Name
Phenol, 2-(2-propen-1-yl)-
Role
alias
Source
itcmdb_public
Preferred
No
Name
Phenol, 2-(2-propenyl)-
Role
alias
Source
HERB_v2
Preferred
No
Name
Phenol, 2-(2-propenyl)-
Role
alias
Source
itcmdb_public
Preferred
No
Name
Phenol, o-allyl-
Role
alias
Source
itcmdb_public
Preferred
No
Name
Phenol, o-allyl-
Role
alias
Source
HERB_v2
Preferred
No
Name
o-Allylphenol
Role
alias
Source
HERB_v2
Preferred
No
Name
o-Allylphenol
Role
alias
Source
itcmdb_public
Preferred
No
Aliases
Additional names normalized into the restored final schema.
2-(2-Propenyl) phenol大良姜DA LIANG JIANGGalanga Galangal1745-81-92-(prop-2-en-1-yl)phenol2-ALLYLPHENOL2-prop-2-enylphenolPhenol, (2-propenyl)-Phenol, 2-(2-propen-1-yl)-Phenol, 2-(2-propenyl)-Phenol, o-allyl-o-Allylphenol
Cross References
Trusted external identifiers retained for this final record.
Herb
HBIN003756
Npass
NPC155393
Tcmid
17909
Pub Chem
15624
Tcmbank
TCMBANKIN019447TCMBANKIN034435
Itcmdb Generated
ITX-INGREDIENT-AB3E50D13F09
Attributes
Merged source attributes and domain-specific metadata.
In Ch I
InChI=1S/C9H10O/c1-2-5-8-6-3-4-7-9(8)10/h2-4,6-7,10H,1,5H2
Mol Wt
134.178
Smiles
C=CCC1=CC=CC=C1O
Mol Log P
2.120700000000001
In Ch Ikey
QIRNGVVZBINFMX-UHFFFAOYSA-N
Tcm Name
大良姜
Tcm Name2
DA LIANG JIANG
Mol2 Path
/TCM_database/2007_3d_all/17923.mol2
Reference
660
Num Hdonors
1
Tcm Name En
Galanga Galangal
Drug Likeness
0.614
Num Hacceptors
1
Isomeric Smiles
C=CCC1=CC=CC=C1O
Canonical Smiles
C=CCC1=CC=CC=C1O
Herb Alias Names
2-ALLYLPHENOL1745-81-9o-AllylphenolPhenol, o-allyl-2-(prop-2-en-1-yl)phenolPhenol, 2-(2-propenyl)-2-prop-2-enylphenolPhenol, 2-(2-propen-1-yl)-Phenol, (2-propenyl)-
Molecular Weight
134.17 g/mol
Molecular Formula
C9H10O
Molecular Formula
C9H10O
Num Rotatable Bonds
2