gamma-Amanitine
2-[34-butan-2-yl-8,22-dihydroxy-13-(3-hydroxybutan-2-yl)-2,5,11,14,30,33,36,39-octaoxo-27-thia-3,6,12,15,25,29,32,35,38-nonazapentacyclo[14.12.11.06,10.018,26.019,24]nonatriaconta-18(26),19(24),20,22-tetraen-4-yl]acetamide
Also Known As: gamma-Amanitine, gamma-Amatoxin, GAMMA-AMANITIN, Rhenium chloride (ReCl3), 4-FLUOROACETOPHENONEOXIME, HSDB 3460, EINECS 236-970-9, 2-[29-(butan-2-yl)-2,14-dihydroxy-21-(3-hydroxybutan-2-yl)-5,8,20,23,24,27,30,33-octaoxo-1,2,3,5,6,7,8,9,10,12,17,18,19,20,21,22,23,23a-octadecahydro-9,18-(epiminoethanoiminoethanoiminoethanoiminomethano)pyrrolo[1',2':8,9][1,5,8,11,14]thiatetraazacyclooctadecino[18,17-b]indol-6-yl]acetamide
| Molecular Formula | C39H54N10O12S |
|---|---|
| Molecular Weight | 886.3643 g/mol |
| LogP | -3.91 |
| Topological Polar Surface Area | 343.58 Ų |
| Hydrogen Bond Donors | 12 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 6 |
| Exact Mass | 886.3643 |
| Heavy Atoms | 62 |
| Complexity | 2096 |
Chemical Identifiers
| CAS Number | 13567-11-8 |
|---|---|
| SMILES | CCC(C)C1C(=O)NCC(=O)NC2CSC3=C(CC(C(=O)NCC(=O)N1)NC(=O)C(NC(=O)C4CC(CN4C(=O)C(NC2=O)CC(=O)N)O)C(C)C(C)O)C5=C(N3)C=C(C=C5)O |
Product Overview
gamma-Amanitine (CAS 13567-11-8), with molecular formula C39H54N10O12S and molecular weight 886.3643 g/mol. IUPAC: 2-[34-butan-2-yl-8,22-dihydroxy-13-(3-hydroxybutan-2-yl)-2,5,11,14,30,33,36,39-octaoxo-27-thia-3,6,12,15,25,29,32,35,38-nonazapentacyclo[14.12.11.06,10.018,26.019,24]nonatriaconta-18(26),19(24),20,22-tetraen-4-yl]acetamide.
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