| CAS Number | 23109-05-9 |
| Catalog Number | AG00BBUN(AGN-PC-0QZKI8) |
| Chemical Name | Alpha-Amanitin |
| EC Number | 245-432-2 |
| IUPAC Name | 2-[(1R,4S,8R,10S,13S,16S,34S)-34-[(2S)-butan-2-yl]-13-[(2R,3R)-3,4-dihydroxybutan-2-yl]-8,22-dihydroxy-2,5,11,14,27,30,33,36,39-nonaoxo-27λ4-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 |
| InChI | InChI=1S/C39H54N10O14S/c1-4-16(2)31-36(60)42-11-29(55)43-25-15-64(63)38-21(20-6-5-18(51)7-22(20)46-38)9-23(33(57)41-12-30(56)47-31)44-37(61)32(17(3)27(53)14-50)48-35(59)26-8-19(52)13-49(26)39(62)24(10-28(40)54)45-34(25)58/h5-7,16-17,19,23-27,31-32,46,50-53H,4,8-15H2,1-3H3,(H2,40,54)(H,41,57)(H,42,60)(H,43,55)(H,44,61)(H,45,58)(H,47,56)(H,48,59)/t16-,17-,19+,23-,24-,25-,26-,27-,31-,32-,64?/m0/s1 |
| InChI Key | CIORWBWIBBPXCG-JAXJKTSHSA-N |
| MDL Number | MFCD30207890 |
| Molecular Formula | C39H54N10O14S |
| Molecular Weight | 918.9697 |
| SMILES | O=S1C2=C(C=3C(N2)=CC(O)=CC3)C[C@@]4(NC(=O)[C@]([C@H]([C@H](CO)O)C)(NC(=O)[C@]5(N(C(=O)[C@H](CC(N)=O)NC(=O)[C@](C1)(NC(=O)CNC(=O)[C@]([C@H](CC)C)(NC(=O)CNC4=O)[H])[H])C[C@H](O)C5)[H])[H])[H] |
| Synonyms | Alpha Amanitin,
Alpha Amanitine,
Alpha-Amanitin,
Alpha-Amanitine,
alpha-amanitin,
alpha-Amanitine,
23109-05-9,
alpha-Amatoxin,
UNII-E04K0QZ999,
HSDB 3458,
EINECS 245-432-2,
BRN 1071138,
E04K0QZ999,
Cyclic(L-asparaginyl-4-hydroxy-L-prolyl-(R)-4,5-dihydroxy-L-isoleucyl-6-hydroxy-2-mercapto-L-tryptophylglycyl-L-isoleucylglycyl-L-cysteinyl), cyclic (4-8)-sulfide, (R)-S-oxide,
CHEMBL3792970,
SCHEMBL16491633,
AKOS024457936,
CS-5321,
HY-19610,
(cyclic(L)-asparaginyl-4-hydroxy-L-proly-(R)-4,5-dihydroxy-L-isoleucyl-6-hydroxy-2-mercapto-L-tryptophylglycyl-Lisoleucylglycyl-L-cysteinyl) cyclic (4 inverted exclamation marku 8)-sulfide(R)-S-oxide.,
9,18-(Iminoethaniminoethaniminoethaniminomethano)pyrrolo(1',2':8,9)(1,5,8,11,14)thiatetraazacyclooctadecino(18,17-b)indole, cyclic peptide deriv.,
cyclo[L-Asparaginyl-4-hydroxy-L-proly-(R-4,5-dihydroxy-L-isoleucyl-6-hydroxy-2-mercapto-L-tryptophylglycyl-L-isoleucylglycyl-L-cysteinyl]cyclic (4?8)-sulfide (R)-S-oxide,
Alpha Amanitine,
Alpha Amanitin,
?-Amanitin,
.alpha.-Amanitin,
C39H54N10O14S,
C39-H54-N10-O14-S,
alpha-Amanitin - fungal fermentation origin,
D053959,
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