IngredientID 35534

Trans-p-coumaric acid ethyl ester

C11H12O3

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Relationship Network

Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.

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Herb: 1Ingredient: 1Target: 7Links: 8
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Record Fields

Scalar fields from the final ingredient record.

Ingredient Id
35534
Core Entity Id
42688
Source Entity Count
1
Preferred Name
Trans-p-coumaric acid ethyl ester
Name En
Pubchem Id
676946
Smiles Canonical
CCOC(=O)C=CC1=CC=C(C=C1)O
Molecular Formula
C11H12O3
Molecular Weight
192.2100
Inchikey
ZOQCEVXVQCPESC-VMPITWQZSA-N
Inchi
InChI=1S/C11H12O3/c1-2-14-11(13)8-5-9-3-6-10(12)7-4-9/h3-8,12H,2H2,1H3/b8-5+
Isomeric Smiles
Cas Id
Ob Score
Mol Logp
2.6000
Num H Donors
1
Num H Acceptors
3
Num Rotatable Bonds
4
Drug Likeness
Polar Surface Area
46.5000
Molecular Volume
Alogp

Names

Preferred names, aliases, and source labels retained in the final schema.

Name
TRANS-p-coumaric acid ethyl ester
Role
preferred
Source
TCMBank
Preferred
Yes
Name
Trans-p-coumaric acid ethyl ester
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
Trans-p-coumaric acid ethyl ester
Role
preferred
Source
itcmdb_public
Preferred
Yes

Cross References

Trusted external identifiers retained for this final record.

Herb
HBIN046803
Tcmid
34033
Tcmbank
TCMBANKIN016700