Aspercolorin
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| Category | Others |
| Catalog number | BBF-04597 |
| CAS | 29123-52-2 |
| Molecular Weight | 464.51 |
| Molecular Formula | C25H28N4O5 |
| Purity | >97% by HPLC |
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Description
An atypical cyclic tetrapeptide in which one of the amino acids is a 5-methoxyanthranilic acid. Aspercolorin is a fungal metabolite produced by Aspergillus versicolor. It is used as a secondary metabolite standard in polyphasic taxonomy for the identification of aspergillus versicolor.
Specification
| Synonyms | 1,2,3,5,6,7,8,9,10,11,12,17,18,18a-Tetradecahydro-10-benzyl-14-methoxypyrrolo[1,2-a][1,4,8,11]benzotetraazacyclotetradecine-5,9,12,18-tetrone; 10-benzyl-14-methoxy-1,2,3,7,8,10,11,18a-octahydrobenzo[e]pyrrolo[1,2-a][1,4,8,11]tetraazacyclotetradecine-5,9,12,18(6H,17H)-tetraone; Cyclo(β-alanylprolyl-2-amino-5-methoxybenzoylphenylalanyl) |
| Storage | Store at -20°C |
| IUPAC Name | 14-benzyl-19-methoxy-2,8,12,15-tetrazatricyclo[15.4.0.04,8]henicosa-1(17),18,20-triene-3,9,13,16-tetrone |
| Canonical SMILES | COC1=CC2=C(C=C1)NC(=O)C3CCCN3C(=O)CCNC(=O)C(NC2=O)CC4=CC=CC=C4 |
| InChI | InChI=1S/C25H28N4O5/c1-34-17-9-10-19-18(15-17)23(31)28-20(14-16-6-3-2-4-7-16)24(32)26-12-11-22(30)29-13-5-8-21(29)25(33)27-19/h2-4,6-7,9-10,15,20-21H,5,8,11-14H2,1H3,(H,26,32)(H,27,33)(H,28,31) |
| InChI Key | KABHYYPZHZXPIU-UHFFFAOYSA-N |
| Source | Aspergillus versicolor |
Properties
| Appearance | Light Tan Solid |
| Boiling Point | 864.0±65.0°C (Predicted) |
| Melting Point | 158°C |
| Density | 1.33±0.1 g/cm3 (Predicted) |
| Solubility | Soluble in Ethanol, Methanol, DMF, DMSO |
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Bio Calculators
* Our calculator is based on the following equation:
Concentration (start) x Volume (start) = Concentration (final) x Volume (final)
It is commonly abbreviated as: C1V1 = C2V2
* Total Molecular Weight:
g/mol
Tip: Chemical formula is case sensitive. C22H30N4O √ c22h30n40 ╳
