Anhydroepiophiobolin A
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| Category | Bioactive by-products |
| Catalog number | BBF-04202 |
| CAS | 90411-20-4 |
| Molecular Weight | 382.54 |
| Molecular Formula | C25H34O3 |
| Purity | >98% by HPLC |
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Description
Anhydroepiophiobolin A is an ophiobolin with a broad biological profile. It has antibacterial, antifungal, antitumour, herbicidal and nematocidal activities. It is the major terminal degradation product of ophiobolin A and is co-produced with other ophiobolins in many bipolaris species.
Specification
| Synonyms | (6α,18R)-14,18-epoxy-5-oxo-ophiobola-3,7,19-trien-25-al; (2'S,3'S,3aR,5'R,6aR,9aS,10aR)-2,3a,4,4',5',6a,7,9a,10,10a-decahydro-3',9,10a-trimethyl-5'-(2-methyl-1-propen-1-yl)-7-oxospiro[dicyclopenta[a,d]cyclooctene-3(1H),2'(3'H)-furan]-6-carboxaldehyde; 3-Anhydro-6-epi-ophiobolin A; [3S-[3α(3'R*,5'S*),3aα,6aα,9aβ,10aβ]]-1,3a,4,4',5',6a,7,9a,10,10a-decahydro-3',9,10a-trimethyl-5'-(2-methyl-1-propenyl)-7-oxospiro[dicyclopenta[a,d]cyclooctene-3(2H),2'(3'H)-furan]-6-carboxaldehyde |
| Storage | Store at -20°C |
| IUPAC Name | (1'R,2S,3S,3'S,5R,7'R,8'E,11'R)-1',3,4'-trimethyl-5-(2-methylprop-1-enyl)-6'-oxospiro[oxolane-2,12'-tricyclo[9.3.0.03,7]tetradeca-4,8-diene]-8'-carbaldehyde |
| Canonical SMILES | CC1CC(OC12CCC3(C2CC=C(C4C(C3)C(=CC4=O)C)C=O)C)C=C(C)C |
| InChI | InChI=1S/C25H34O3/c1-15(2)10-19-12-17(4)25(28-19)9-8-24(5)13-20-16(3)11-21(27)23(20)18(14-26)6-7-22(24)25/h6,10-11,14,17,19-20,22-23H,7-9,12-13H2,1-5H3/b18-6-/t17-,19-,20+,22+,23-,24+,25-/m0/s1 |
| InChI Key | MDYSLOGZXCWLSL-MUKMEUIDSA-N |
| Source | Bipolaris sp. |
Properties
| Appearance | White Solid |
| Antibiotic Activity Spectrum | Neoplastics (Tumor); Fungi; Parasites; Bacteria |
| Boiling Point | 520.6±50.0°C (Predicted) |
| Density | 1.10±0.1 g/cm3 (Predicted) |
| Solubility | Soluble in Ethanol, Methanol, DMF, DMSO; Poorly soluble in Water |
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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 ╳
