3-(o-(Bis(beta-chloroethyl)amino)phenyl)-D,L-alanine

CAS 342-95-0 MFCD N/A

化学结构图

342-95-0
SMILES: NC(Cc1ccccc1N(CCCl)CCCl)C(=O)O

化学属性

Mol. Weight305.23
Mol. FormulaC13H18Cl2N2O2

别名和识别编码

Synonym Merophan DL-Alanine, 3-(o-(bis(2-chloroethyl)amino)phenyl)- CB 1729 o-DL-Sarcolysin Ortho-phenylalanine mustard NSC-57199 FDA 0109 o-Phenylalanine mustard (+-)-O-Phenylalanine mustard o-Merphalan DL-Phenylalanine, 2-(bis(2-chloroethyl)amino)- o-Di-2-chloroethylamino-DL-phenylalanine 3-(o-(Bis(beta-chloroethyl)amino)phenyl)-D,L-alanine
Wiswesser Line NotationQVYZ1R BN2G2G
Chemical Nameortho-Phenylalanine mustard
CAS Number342-95-0
InChIKeyZJHNCWIVJDCKSB-UHFFFAOYSA-N
PubChem Substance ID9571
InChIInChI=1S/C13H18Cl2N2O2/c14-5-7-17(8-6-15)12-4-2-1-3-10(12)9-11(16)13(18)19/h1-4,11H,5-9,16H2,(H,18,19)
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安全信息

RTECSAY3400000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 18480 ug/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   NCISP* National Cancer Institute Screening Program Data Summary,
   Developmental Therapeutics Program. (Bethesda, MD 20205)
   Volume(issue)/page/year: JAN1986

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 3510 ug/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   BCPCA6 Biochemical Pharmacology.  (Pergamon Press Inc., Maxwell House,
   Fairview Park, Elmsford, NY 10523)  V.1-    1958-  Volume(issue)/page/year:
   13,969,1964

TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Primate - monkey
DOSE/DURATION           : 380 ug/kg
TOXIC EFFECTS :
   Blood - leukopenia
   Blood - other changes
REFERENCE :
   CCSUBJ Cancer Chemotherapy Reports, Part 2.  (Washington, DC)  V.1-5,
   1964-75.  For publisher information, see CTRRDO.  Volume(issue)/page/year:
   2,201,1965

TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Mammal - dog
DOSE/DURATION           : 190 ug/kg
TOXIC EFFECTS :
   Blood - leukopenia
   Blood - thrombocytopenia
   Blood - other changes
REFERENCE :
   CCSUBJ Cancer Chemotherapy Reports, Part 2.  (Washington, DC)  V.1-5,
   1964-75.  For publisher information, see CTRRDO.  Volume(issue)/page/year:
   2,201,1965

系列性分类

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