Aflavazole

For Research Use Only.
Category
Diterpenoids
Cat.No.
NP1576
CAS
2043963-70-6
Product Name
Aflavazole
Structure

Product Details

Description
Aflavazole is a metabolite of the sclerotia of Aspergillus flavus. It shows antifeedant activity against the fungivorous beetle Carpophilus hemipterus remarkably.
Synonyms
(1R,4S,4aS,13dS,14R,16R,16aS)-1,2,3,4,5,6,9,13d,14,15,16,16a-Dodecahydro-1,7,14,16a-tetramethylphenanthro[2,1-c]carbazole-4,16-diol; (+)-Aflavazole; Benzo(4a,5)naphtho(2,1-c)carbazole-4,16-diol, 1,2,3,4,5,6,9,13d,14,15,16,16a-dodecahydro-1,7,14,16a-tetramethyl-, (1alpha,4alpha,4aS*,13dbeta,14alpha,16beta,16aalpha)-(+)-; Benzo(4a,5)naphtho(2,1-c)carbazole-4,16-diol,1,2,3,4,5,6,9,13d,14,15,16,16a-dodecahydro-1,7,16a-tetramethyl-, (1R,4S,4aS,13dS,14R,16R,16aS)-rel-(+)-
IUPAC Name
(2S,3R,5R,6S,7R,10S,11S)-3,6,7,15-tetramethyl-18-azahexacyclo[12.11.0.02,11.06,11.017,25.019,24]pentacosa-1(14),15,17(25),19,21,23-hexaene-5,10-diol
Molecular Weight
417.58
Molecular Formula
C28H35NO2
Canonical SMILES
CC1CCC(C23C1(C(CC(C2C4=C(CC3)C(=CC5=C4C6=CC=CC=C6N5)C)C)O)C)O
InChI
InChI=1S/C28H35NO2/c1-15-13-21-24(19-7-5-6-8-20(19)29-21)25-18(15)11-12-28-22(30)10-9-17(3)27(28,4)23(31)14-16(2)26(25)28/h5-8,13,16-17,22-23,26,29-31H,9-12,14H2,1-4H3/t16-,17-,22+,23-,26+,27-,28+/m1/s1
InChIKey
CXQOHHTZVIKVEM-KOOUEZQKSA-N
Boiling Point
630.6°C at 760 mmHg
Melting Point
156-160°C
Purity
97.5%
Density
1.23 g/cm3
Solubility
Soluble in Methanol
Appearance
Light Yellow Crystal
Storage
Store at -20°C
Form
Powder
Packaging
1 mg
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