N1,N5,N10-Tri-p-coumaroylspermidine

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For Research Use Only.

Size	Price	Stock	Quantity
1 mg	$439	In stock

Category

Alkaloids

Cat.No.

NP0624

CAS

131086-78-7

Product Name

N1,N5,N10-Tri-p-coumaroylspermidine

Structure

Product Details

Description

Tricoumaroyl spermidine is a unique metabolite of tea (Camellia sinensis) flower.

Synonyms

Tricoumaroyl spermidine; 2-Propenamide, 3-(4-hydroxyphenyl)-N-[4-[[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propen-1-yl]amino]butyl]-N-[3-[[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propen-1-yl]amino]propyl]-, (2E)-; (2E)-3-(4-Hydroxyphenyl)-N-[4-[[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propen-1-yl]amino]butyl]-N-[3-[[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propen-1-yl]amino]propyl]-2-propenamide; 2-Propenamide, 3-(4-hydroxyphenyl)-N-[4-[[3-(4-hydroxyphenyl)-1-oxo-2-propenyl]amino]butyl]-N-[3-[[3-(4-hydroxyphenyl)-1-oxo-2-propenyl]amino]propyl]-, (E,E,E)-; N1,N5,N10-(E)-Tri-p-coumaroylspermidine; N1,N5,N10-Tri-p-(E)-coumaroylspermidine

IUPAC Name

(E)-3-(4-hydroxyphenyl)-N-[4-[[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]-[3-[[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]amino]propyl]amino]butyl]prop-2-enamide

Molecular Weight

583.68

Molecular Formula

C34H37N3O6

Canonical SMILES

C1=CC(=CC=C1C=CC(=O)NCCCCN(CCCNC(=O)C=CC2=CC=C(C=C2)O)C(=O)C=CC3=CC=C(C=C3)O)O

InChI

InChI=1S/C34H37N3O6/c38-29-13-4-26(5-14-29)10-19-32(41)35-22-1-2-24-37(34(43)21-12-28-8-17-31(40)18-9-28)25-3-23-36-33(42)20-11-27-6-15-30(39)16-7-27/h4-21,38-40H,1-3,22-25H2,(H,35,41)(H,36,42)/b19-10+,20-11+,21-12+

InChIKey

PFDVWJCSCYDRMZ-AUCPOXKISA-N

Boiling Point

954.2±65.0°C at 760 mmHg

Melting Point

176-180°C

Purity

98.0%

Density

1.265±0.06 g/cm3

Solubility

Soluble in Acetone, Chloroform, Dichloromethane, DMSO, Ethyl Acetate

Appearance

Powder

Storage

Store at -20°C

Form

Oil

Packaging

1 mg

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