Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 12Ingredient: 1Links: 12
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 64300
- Core Entity Id
- 111318
- Source Entity Count
- 1
- Preferred Name
- Methyl Ester
- Name En
- Pubchem Id
- Smiles Canonical
- Molecular Formula
- C17H28O2
- Molecular Weight
- 264.2100
- Inchikey
- Inchi
- Isomeric Smiles
- Cas Id
- Ob Score
- 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
Methyl Ester
Role
Molecule_name
Source
SymMap_v2
Preferred
Yes
Name
Methyl Ester
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
methyl ester
Role
preferred
Source
ETCM_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Sym Map
SMIT25377
Etcm Ingredient
methyl ester
Itcmdb Generated
ITX-INGREDIENT-5A8EFBA04515ITX-INGREDIENT-D57971E889CC
Attributes
Merged source attributes and domain-specific metadata.
Type
Other ingredients
Version
v2
Suppress
0
Molecular Weight
264.210
Molecular Formula
C17H28O2
Fda Maximum Daily Dose (Fdamdd)
0.027
Quantitative Estimate Of Drug Likeness（Qed）
0.299