IngredientID 4528
(e)-2-propenoic acid,3-(3-hydroxy-2,6,6-trimethyl-1-cyclohexen-1-yl),methyl ester
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Ingredient: 1Target: 12Links: 12
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Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 4528
- Core Entity Id
- 8223
- Source Entity Count
- 1
- Preferred Name
- (e)-2-propenoic acid,3-(3-hydroxy-2,6,6-trimethyl-1-cyclohexen-1-yl),methyl ester
- Name En
- Pubchem Id
- Smiles Canonical
- Molecular Formula
- Molecular Weight
- 224.3300
- Inchikey
- Inchi
- Isomeric Smiles
- Cas Id
- Ob Score
- 30.6970
- Mol Logp
- Num H Donors
- Num H Acceptors
- Num Rotatable Bonds
- Drug Likeness
- Polar Surface Area
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
(E)-2-Propenoic Acid,3-(3-Hydroxy-2,6,6-Trimethyl-1-Cyclohexen-1-Yl),Methyl Ester
Role
Molecule_name
Source
SymMap_v2
Preferred
Yes
Name
(E)-2-Propenoic Acid,3-(3-Hydroxy-2,6,6-Trimethyl-1-Cyclohexen-1-Yl),Methyl Ester
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
(E)-2-propenoic acid,3-(3-hydroxy-2,6,6-trimethyl-1-cyclohexen-1-yl),methyl ester
Role
preferred
Source
TCMBank
Preferred
Yes
Name
(e)-2-propenoic acid,3-(3-hydroxy-2,6,6-trimethyl-1-cyclohexen-1-yl),methyl ester
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
(e)-2-propenoic acid,3-(3-hydroxy-2,6,6-trimethyl-1-cyclohexen-1-yl),methyl ester
Role
preferred
Source
itcmdb_public
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Herb
HBIN024655
Tcmsp
MOL003539
Sym Map
SMIT05596
Tcmbank
TCMBANKIN000349
Attributes
Merged source attributes and domain-specific metadata.
Type
Other ingredients
Version
v1,v2
Ob Score
30.69730.69728730.69728738
Suppress
0
Molecule Weight
224.33
Molecular Weight
224.33