Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 2Ingredient: 1Links: 2
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 18188
- Core Entity Id
- 23392
- Source Entity Count
- 1
- Preferred Name
- E-p-hydroxy-cinnamic acid
- Name En
- Pubchem Id
- 5319676
- Smiles Canonical
- CC1=C(C=CC(=C1)C=CC(=O)O)O
- Molecular Formula
- C10H10O3
- Molecular Weight
- 178.1870
- Inchikey
- NBGWMNZWLGXONC-HWKANZROSA-N
- Inchi
- InChI=1S/C10H10O3/c1-7-6-8(2-4-9(7)11)3-5-10(12)13/h2-6,11H,1H3,(H,12,13)/b5-3+
- Isomeric Smiles
- CC1=C(C=CC(=C1)/C=C/C(=O)O)O
- Cas Id
- Ob Score
- Mol Logp
- 1.7984
- Num H Donors
- 2
- Num H Acceptors
- 2
- Num Rotatable Bonds
- 2
- Drug Likeness
- 0.6790
- Polar Surface Area
- 57.5000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
(E-P-Hydroxy-Cinnamic Acid
Role
Molecule_name
Source
SymMap_v2
Preferred
Yes
Name
(E-P-Hydroxy-Cinnamic Acid
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
(e-p-hydroxy-cinnamic acid
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
(e-p-hydroxy-cinnamic acid
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
E-p-hydroxy-cinnamic acid
Role
preferred
Source
TCMBank
Preferred
Yes
Name
(E)-3-(4-hydroxy-3-methylphenyl)acrylic Acid
Role
alias
Source
HERB_v2
Preferred
No
Name
(E)-3-(4-hydroxy-3-methylphenyl)acrylic Acid
Role
alias
Source
itcmdb_public
Preferred
No
Name
(E)-3-(4-hydroxy-3-methylphenyl)prop-2-enoic acid
Role
alias
Source
itcmdb_public
Preferred
No
Name
(E)-3-(4-hydroxy-3-methylphenyl)prop-2-enoic acid
Role
alias
Source
HERB_v2
Preferred
No
Name
19780-88-2
Role
alias
Source
itcmdb_public
Preferred
No
Name
19780-88-2
Role
alias
Source
HERB_v2
Preferred
No
Name
377091-82-2
Role
alias
Source
itcmdb_public
Preferred
No
Name
377091-82-2
Role
alias
Source
HERB_v2
Preferred
No
Name
4-HYDROXY-3-METHYLCINNAMIC ACID
Role
alias
Source
HERB_v2
Preferred
No
Name
4-HYDROXY-3-METHYLCINNAMIC ACID
Role
alias
Source
itcmdb_public
Preferred
No
Name
AKOS006276932
Role
alias
Source
HERB_v2
Preferred
No
Name
AKOS006276932
Role
alias
Source
itcmdb_public
Preferred
No
Name
SCHEMBL471934
Role
alias
Source
HERB_v2
Preferred
No
Name
SCHEMBL471934
Role
alias
Source
itcmdb_public
Preferred
No
Aliases
Additional names normalized into the restored final schema.
(E-P-Hydroxy-Cinnamic Acid(E)-3-(4-hydroxy-3-methylphenyl)acrylic Acid(E)-3-(4-hydroxy-3-methylphenyl)prop-2-enoic acid19780-88-2377091-82-24-HYDROXY-3-METHYLCINNAMIC ACIDAKOS006276932SCHEMBL471934
Cross References
Trusted external identifiers retained for this final record.
Herb
HBIN025244HBIN025245
Npass
NPC133082
Tcmid
3771541844
Sym Map
SMIT19989
Pub Chem
5319676
Tcmbank
TCMBANKIN014371
Itcmdb Generated
ITX-INGREDIENT-0CB60F0BDAD5
Attributes
Merged source attributes and domain-specific metadata.
Type
Other ingredients
In Ch I
InChI=1S/C10H10O3/c1-7-6-8(2-4-9(7)11)3-5-10(12)13/h2-6,11H,1H3,(H,12,13)/b5-3+
Mol Wt
178.187
Mol Log P
1.79842
Version
v2
In Ch Ikey
NBGWMNZWLGXONC-HWKANZROSA-N
Suppress
0
Num Hdonors
2
Drug Likeness
0.679
Num Hacceptors
2
Isomeric Smiles
CC1=C(C=CC(=C1)/C=C/C(=O)O)O
Canonical Smiles
CC1=C(C=CC(=C1)C=CC(=O)O)O
Herb Alias Names
4-HYDROXY-3-METHYLCINNAMIC ACID19780-88-2(E)-3-(4-hydroxy-3-methylphenyl)prop-2-enoic acid(E)-3-(4-hydroxy-3-methylphenyl)acrylic AcidSCHEMBL471934AKOS006276932377091-82-2
Molecular Formula
C10H10O3
Num Rotatable Bonds
2