Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 1Ingredient: 1Target: 3Links: 7
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 65731
- Core Entity Id
- 128380
- Source Entity Count
- 1
- Preferred Name
- (E)-methyl cinnamate
- Name En
- Pubchem Id
- 637520
- Smiles Canonical
- COC(=O)C=CC1=CC=CC=C1
- Molecular Formula
- C10H10O2
- Molecular Weight
- 162.0700
- Inchikey
- CCRCUPLGCSFEDV-BQYQJAHWSA-N
- Inchi
- InChI=1S/C10H10O2/c1-12-10(11)8-7-9-5-3-2-4-6-9/h2-8H,1H3/b8-7+
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- 2.6000
- Num H Donors
- 0
- Num H Acceptors
- 2
- Num Rotatable Bonds
- 3
- Drug Likeness
- Polar Surface Area
- 26.3000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
(E)-methyl cinnamate
Role
preferred
Source
ETCM_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Etcm Ingredient
(E)-methyl cinnamate
Itcmdb Generated
ITX-INGREDIENT-D84279713ADA
Attributes
Merged source attributes and domain-specific metadata.
Molecular Weight
162.070
Molecular Formula
C10H10O2
Fda Maximum Daily Dose (Fdamdd)
0.020
Quantitative Estimate Of Drug Likeness（Qed）
0.490