Actinomycin E2

CAS 1402-42-2 MFCD01673942

化学结构图

1402-42-2
SMILES: CC[C@H](C)[C@H]1C(=O)O[C@H](C)[C@H](NC(=O)c2c3nc4c(C(=O)N[C@@H]5C(=O)N[C@H]([C@@H](C)CC)C(=O)N6CCC[C@H]6C(=O)N(C)CC(=O)N(C)[C@@H]([C@@H](C)CC)C(=O)O[C@@H]5C)ccc(C)c4oc-3c(C)c(=O)c2N)C(=O)N[C@H]([C@@H](C)CC)C(=O)N2CCC[C@H]2C(=O)N(C)CC(=O)N1C

化学属性

Mol. FormulaC66H94N12O16
Mol. Weight1311.72

别名和识别编码

Chemical NameActinomycin D, 2(sup A)-D-alloisoleucine-5(sup A)-(N-methylisoleucine)-5(sup B)-(N-methylisoleucine)-
InChIKeyICMBEGIECJGHSL-UHFFFAOYSA-N
Synonym Actinomycin E2
CAS Number1402-42-2
PubChem Substance ID200245
InChIInChI=1S/C66H94N12O16/c1-17-31(5)46-63(88)77-27-21-23-40(77)61(86)73(13)29-42(79)75(15)52(33(7)19-3)65(90)92-37(11)48(59(84)69-46)71-57(82)39-26-25-35(9)55-50(39)68-51-44(45(67)54(81)36(10)56(51)94-55)58(83)72-49-38(12)93-66(91)53(34(8)20-4)76(16)43(80)30-74(14)62(87)41-24-22-28-78(41)64(89)47(32(6)18-2)70-60(49)85/h25-26,31-34,37-38,40-41,46-49,52-53H,17-24,27-30,67H2,1-16H3,(H,69,84)(H,70,85)(H,71,82)(H,72,83)
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安全信息

RTECSAU1578500
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 1 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   85GDA2 "CRC Handbook of Antibiotic Compounds," Vols.1- ,  Berdy, J., Boca
   Raton, FL, CRC Press, 1980-  Volume(issue)/page/year: 4(2),67,1980

系列性分类


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