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CHAETOCIN

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Name: CHAETOCIN
CAS: 28097-03-2
Synonyms: CHETOCIN ; CHAETOCIN FROM CHAETOMIUM MINUTUM ; 2,2',3S,3'S,5AR,5'AR,6,6'-OCTAHYDRO-3,3'-BIS(HYDROXYMETHYL)-2,2'-DIMETHYL-[10BR,10'BR(11AS,11'AS)-BI-3,11A-EPIDITHIO-11AH-PYRAZINO[1',2':1,5]PYRROLO[2,3-B]INDOLE]-1,1',4,4'-TETRONE ; CHAETOCIN
MDL.: MFCD00133163
H bond acceptor: 12
H bond donor: 4
Smile: CN1C(=O)[C@@]23C[C@@]4(c5ccccc5N[C@@H]4N2C(=O)[C@@]1(SS3)CO)[C@]67C[C@]89C(=O)N([C@](C(=O)N8[C@H]6Nc1c7cccc1)(SS9)CO)C
InChi: InChI=1S/C30H28N6O6S4/c1-33-21(39)27-11-25(15-7-3-5-9-17(15)31-19(25)35(27)23(41)29(33,13-37)45-43-27)26-12-28-22(40)34(2)30(14-38,46-44-28)24(42)36(28)20(26)32-18-10-6-4-8-16(18)26/h3-10,19-20,31-32,37-38H,11-14H2,1-2H3/t19-,20-,25+,26+,27+,28+,29+,30+/m1/s1
InChiKey: InChIKey=PZPPOCZWRGNKIR-PNVYSBBASA-N

Property

Safety information

Symbol: GHS07 GHS07
Signal word: Warning
Hazard statements: H302-H312-H332
Precautionary statements: P280
hazard symbol: Xn
Risk Code: R:20/21/22
WGK Germany: 3

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