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86639-52-3,MFCD00871873
Catalog No.:AA0038Y5

86639-52-3 | (S)-4,11-Diethyl-4,9-dihydroxy-1H-pyrano[3',4':6,7]indolizino[1,2-b]quinoline-3,14(4H,12H)-dione

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
99%
in stock  
$9.00   $6.00
- +
250mg
99%
in stock  
$20.00   $14.00
- +
1g
99%
in stock  
$45.00   $31.00
- +
5g
99%
in stock  
$160.00   $112.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA0038Y5
Chemical Name:
(S)-4,11-Diethyl-4,9-dihydroxy-1H-pyrano[3',4':6,7]indolizino[1,2-b]quinoline-3,14(4H,12H)-dione
CAS Number:
86639-52-3
Molecular Formula:
C22H20N2O5
Molecular Weight:
392.4046
MDL Number:
MFCD00871873
SMILES:
CC[C@@]1(O)C(=O)OCc2c1cc1c3nc4ccc(cc4c(c3Cn1c2=O)CC)O
NSC Number:
673596
Properties
Computed Properties
 
Complexity:
820  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
29  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.4  

Synonyms
 
439E812  
Literature

Title: Wallin A, et al. Anticancer effect of SN-38 on colon cancer cell lines with different metastatic potential. Oncol Rep. 2008 Jun;19(6):1493-8.

Title: Jensen NF, et al. Characterization of DNA topoisomerase I in three SN-38 resistant human colon cancer cell lines reveals a newpair of resistance-associated mutations. J Exp Clin Cancer Res. 2016 Mar 31;35:56.

Title: Kawato Y, et al. Intracellular roles of SN-38, a metabolite of the camptothecin derivative CPT-11, in the antitumor effect of CPT-11. Cancer Res. 1991;51(16):4187-4191.

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SDS
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Tags:86639-52-3 Molecular Formula|86639-52-3 MDL|86639-52-3 SMILES|86639-52-3 (S)-4,11-Diethyl-4,9-dihydroxy-1H-pyrano[3',4':6,7]indolizino[1,2-b]quinoline-3,14(4H,12H)-dione
Catalog No.: AA0038Y5
86639-52-3,MFCD00871873
86639-52-3 | (S)-4,11-Diethyl-4,9-dihydroxy-1H-pyrano[3',4':6,7]indolizino[1,2-b]quinoline-3,14(4H,12H)-dione
Pack Size： 100mg
Purity： 99%
in stock
$9.00 $6.00
Pack Size： 250mg
Purity： 99%
in stock
$20.00 $14.00
Pack Size： 1g
Purity： 99%
in stock
$45.00 $31.00
Pack Size： 5g
Purity： 99%
in stock
$160.00 $112.00
Quantity
- +
Add to Card
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bulk Quotation Request
Technical Information
Catalog Number: AA0038Y5
Chemical Name: (S)-4,11-Diethyl-4,9-dihydroxy-1H-pyrano[3',4':6,7]indolizino[1,2-b]quinoline-3,14(4H,12H)-dione
CAS Number: 86639-52-3
Molecular Formula: C22H20N2O5
Molecular Weight: 392.4046
MDL Number: MFCD00871873
SMILES: CC[C@@]1(O)C(=O)OCc2c1cc1c3nc4ccc(cc4c(c3Cn1c2=O)CC)O
NSC Number: 673596
Properties
Complexity: 820  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 1  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 29  
Hydrogen Bond Acceptor Count: 6  
Hydrogen Bond Donor Count: 2  
Isotope Atom Count: 0  
Rotatable Bond Count: 2  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.4  
103: 439E812  
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