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4-Ethyl-4-Hydroxy-3,4,12,14-Tetrahydro-1H-Pyrano[3'4':6,7]Indolizino[1,2-b]Quinoline-3,14-Dione
[CAS 31456-25-4]

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Identification
Name 4-Ethyl-4-Hydroxy-3,4,12,14-Tetrahydro-1H-Pyrano[3'4':6,7]Indolizino[1,2-b]Quinoline-3,14-Dione
Synonyms (.+-.)-Camptothecin; 1H-Pyrano[3',4':6,7]Indolizino[1,2-B]Quinoline-3,14(4H,12H)-Dione-, 4-Ethyl-4-Hydroxy-, (+-)-; Camptothecin (+)-
Molecular Structure CAS#: 31456-25-4, 4-Ethyl-4-Hydroxy-3,4,12,14-Tetrahydro-1H-Pyrano[3'4':6,7]Indolizino[1,2-b]Quinoline-3,14-Dione
Molecular Formula C20H16N2O4
Molecular Weight 348.36
CAS Registry Number 31456-25-4
SMILES C2=C1C=CC=CC1=NC4=C2CN5C(C3=C(C(C(=O)OC3)(CC)O)C=C45)=O
InChI 1S/C20H16N2O4/c1-2-20(25)14-8-16-17-12(7-11-5-3-4-6-15(11)21-17)9-22(16)18(23)13(14)10-26-19(20)24/h3-8,25H,2,9-10H2,1H3
InChIKey VSJKWCGYPAHWDS-UHFFFAOYSA-N
Properties
Density 1.513g/cm3 (Cal.)
Boiling point 757.01°C at 760 mmHg (Cal.)
Flash point 411.625°C (Cal.)
solubility Soluble to 5 mM in DMSO
References
(1) Strom, E. et al.. Small molecule inhibitor of p53 binding to mitochondria protects mice from gamma irradiation, Nature Chemical Biology, 2006
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