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Phenylpropanoids

N-trans-Cinnamoyltyramine

N-反式肉桂酰酪胺

PHY-NP-14356 · Natural product research catalog

Catalog numberPHY-NP-14356
CAS number103188-44-9
Molecular formulaC17H17NO2
Molecular weight267.328 g/mol
Chemical classPhenylpropanoids
Main reported sourceAristolochia cucurbitifolia
Purity / assayMin. 98%
Other purity specifications available on inquiry.

Chemical structure

Chemical structure of N-trans-Cinnamoyltyramine

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Product information

N-trans-Cinnamoyltyramine is listed in the Phenylpropanoids section of the Phytide Bio research catalog. Standard pack sizes are 5, 10, 20, 50 and 100 mg.

For research use only. Not for human or veterinary use, diagnosis or treatment.

Names & identifiers

IUPAC name(E)-N-[2-(4-hydroxyphenyl)ethyl]-3-phenylprop-2-enamide
SMILESC1=CC=C(C=C1)/C=C/C(=O)NCCC2=CC=C(C=C2)O
InChIKeyKGOYCHSKGXJDND-DHZHZOJOSA-N
Subclass / scaffoldCinnamic acid amides
PubChem CID5315911

Computed properties

Exact mass (Da)267.1259Predicted LogP2.7643
Predicted TPSA (Ų)49.33H-bond donors2
H-bond acceptors2Rotatable bonds5

Calculated values from the supplied dataset; not measured batch specifications.

View additional properties & classification
Ring count2
Aromatic rings2
Fraction Csp³0.118
Synthetic accessibility score1.75
QED score0.818
Lipinski rule violations0
NPClassifier pathwayAmino acids and Peptides;Shikimates and Phenylpropanoids
NPClassifier superclassPhenylpropanoids (C6-C3)
NPClassifier classCinnamic acid amides
Parent SMILESO=C(/C=C/c1ccccc1)NCCc1ccc(O)cc1
Parent formulaC17H17NO2
Parent molecular weight267.328
Specified stereocenters0
Unspecified stereocenters0

Reported natural occurrence

Main reported sourceAristolochia cucurbitifolia
Reported source familiesAristolochiaceae; Orchid

Reported natural occurrence does not establish the manufacturing origin of the supplied material.

View occurrence records & references
LOTUS / Wikidata speciesAristolochia cucurbitifolia[1]; Aristolochia elegans[1]; Aristolochia littoralis[1]; Dendrobium nobile[1]
All reported source familiesAristolochiaceae[3]; Orchid[1]
LOTUS species records4
LOTUS reference records3
COCONUT occurrence recordsAmphius huxleyi; Aristolochia cucurbitifolia; Aristolochia elegans; Aristolochia littoralis; Aristolochia mollissima; Casearia lucida; Dendrobium nobile; Dichapetalum toxicarium; Echinogorgia flora; Ipomoea nil; Paeonia veitchii; Phellodendron japonicum MAXIM; Rhamnus procumbens; Teucrium lucidum
COCONUT organism records14
COCONUT identifierCNP0289407.1

Records are inherited from the supplied dataset and are not independently verified. Taxonomic names may include synonyms.

Documents & specifications

Certificate of analysis (COA)Batch-specific COA available on request; no PDF published yet
Safety data sheet (SDS)Not yet published
Storage / solubilityProduct-specific conditions to be confirmed
ShippingConfirmed with the quotation

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