Alpha-Amanitin 0.5μM R00 exp5

Inhibits RNA polymerase II and III, interferes with translocation

PubChem Name: alpha-Amanitin
Synonyms: α-Amanitin; α-Amatoxin
CAS #: 23109-05-9
PubChem CID: 441541
IUPAC: 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-27Œª4-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 Name: 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
Molecular Weight: 919
Canonical SMILES: CCC(C)C1C(=O)NCC(=O)NC2CS(=O)C3=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(CO)O)C5=C(N3)C=C(C=C5)O
Isomeric SMILES: CC[C@H](C)[C@H]1C(=O)NCC(=O)N[C@H]2CS(=O)C3=C(C[C@@H](C(=O)NCC(=O)N1)NC(=O)[C@@H](NC(=O)[C@@H]4C[C@H](CN4C(=O)[C@@H](NC2=O)CC(=O)N)O)[C@@H](C)[C@H](CO)O)C5=C(N3)C=C(C=C5)O
Molecular Formula: C39H54N10O14S

HRMS (ESI-TOF) m/z: (M+H)+ Calcd for C39H54N10O14S 919.36144; found 919.36336

Sensitive/Resistant hits (FDR<0.05)	CRANKS	Score Plot	Top 30 Genes	Screen Similarity	Top 30 Sensitive GO terms	Top 30 Resistant GO terms
7/0	Scores	View	View	View	View	View

Screen	Correlation	Plot
Rifampicin 1μM R00 exp31	0.062	View
Pimelic-diphenylamide-106 0.5μM R00 exp27	0.06	View
Ixabepilone 0.004 to 0.005μM on day4 R04 exp184	0.057	View
CCCP 0.1μM R00 exp10	0.057	View
Wortmannin 0.5μM R00 exp37	0.056	View
Dynasore 7μM R08 exp436	0.054	View
Rifampicin 10μM R00 exp32	0.053	View
S-trityl-L-cysteine 0.5μM R05 exp243	0.053	View
Wortmannin 5μM R00 exp38	0.051	View
Cycloheximide 0.2μM R00 exp15	0.051	View