Demethoxyfumitremorgin C

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For Research Use Only.

Size	Price	Stock	Quantity
1 mg	$629	In stock

Category

Alkaloids

Cat.No.

NP0652

CAS

111768-16-2

Product Name

Demethoxyfumitremorgin C

Structure

Product Details

Description

Demethoxyfumitremorgin C is a metabolite of Aspergillus fumigatus. Demethoxyfumitremorgin C acts as a fungal inhibitor of mammalian cell cycle progression at the G(2)/M transition.

Synonyms

(5aS,12S,14aS)-12-(2-methylprop-1-en-1-yl)-1,2,3,5a,6,11,12,14a-octahydro-5H,14H-pyrrolo[1'',2'':4',5']pyrazino[1',2':1,6]pyrido[3,4-b]indole-5,14-dione; (+)-Demethoxyfumitremorgin C; (5aS,12S,14aS)-12-(2-Methylprop-1-en-1-yl)-1,2,3,5a,6,14a-hexahydropyrrolo[1'',2'':4',5']pyrazino[1',2':1,6]pyrido[3,4-b]indole-5,14(11H,12H)-dione

IUPAC Name

(1S,12S,15S)-12-(2-methylprop-1-enyl)-10,13,19-triazapentacyclo[11.7.0.03,11.04,9.015,19]icosa-3(11),4,6,8-tetraene-14,20-dione

Molecular Weight

349.43

Molecular Formula

C21H23N3O2

Canonical SMILES

CC(=CC1C2=C(CC3N1C(=O)C4CCCN4C3=O)C5=CC=CC=C5N2)C

InChI

InChI=1S/C21H23N3O2/c1-12(2)10-17-19-14(13-6-3-4-7-15(13)22-19)11-18-20(25)23-9-5-8-16(23)21(26)24(17)18/h3-4,6-7,10,16-18,22H,5,8-9,11H2,1-2H3/t16-,17-,18-/m0/s1

InChIKey

LQXCSIKDOISJTI-BZSNNMDCSA-N

Boiling Point

617.8±55.0°C (Predicted)

Melting Point

210-212°C

Purity

≥98%

Density

1.33±0.1 g/cm3 (Predicted)

Solubility

Soluble in Methanol

Appearance

Pale Yellow Needles

Storage

Store at 2-8°C

Color

Yellow

Form

Powder

Packaging

1 mg

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