Lanatozid C
(преусмерено са JAYAGJDXJIDEKI-QRNWNWNMSA-N)
Lanatozid C je organsko jedinjenje, koje sadrži 49 atoma ugljenika i ima molekulsku masu od 985,116 Da.
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Klinički podaci | |
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Drugs.com | C.html Monografija |
Identifikatori | |
CAS broj | 17575-22-3 ![]() |
ATC kod | C01AA06 (WHO) |
PubChem | CID 656630 |
ChemSpider | 570984 ![]() |
UNII | 5RR3JFZ771 ![]() |
KEGG | D01972 ![]() |
ChEMBL | CHEMBL506569 ![]() |
Sinonimi | [6-[6-[6-[[12,14-dihydroxy- 10,13-dimethyl- 17-(5-oxo-2H-furan-3-yl)- 1,2,3,4,5,6,7,8,9,11,12,15,16,17- tetradecahydrocyclopenta[a]phenanthren- 3-yl]oxy]- 4-hydroxy- 2-methyloxan- 3-yl]oxy- 4-hydroxy- 2-methyloxan-3-yl]oxy- 2-methyl- 3-[3,4,5-trihydroxy- 6-(hydroxymethyl)oxan-2-yl]oxyoxan- 4-yl] acetate |
Hemijski podaci | |
Formula | C49H76O20 |
Molarna masa | 985,116 |
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Osobine
уредиOsobina | Vrednost |
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Broj akceptora vodonika | 20 |
Broj donora vodonika | 8 |
Broj rotacionih veza | 12 |
Particioni koeficijent[1] (ALogP) | 0,6 |
Rastvorljivost[2] (logS, log(mol/L)) | -5,5 |
Polarna površina[3] (PSA, Å2) | 288,3 |
Reference
уреди- ^ Ghose, A.K.; Viswanadhan V.N. & Wendoloski, J.J. (1998). „Prediction of Hydrophobic (Lipophilic) Properties of Small Organic Molecules Using Fragment Methods: An Analysis of AlogP and CLogP Methods”. J. Phys. Chem. A. 102: 3762—3772. doi:10.1021/jp980230o.
- ^ Tetko IV, Tanchuk VY, Kasheva TN, Villa AE (2001). „Estimation of Aqueous Solubility of Chemical Compounds Using E-State Indices”. Chem Inf. Comput. Sci. 41: 1488—1493. PMID 11749573. doi:10.1021/ci000392t.
- ^ Ertl P.; Rohde B.; Selzer P. (2000). „Fast calculation of molecular polar surface area as a sum of fragment based contributions and its application to the prediction of drug transport properties”. J. Med. Chem. 43: 3714—3717. PMID 11020286. doi:10.1021/jm000942e.
Literatura
уреди- Hardman JG, Limbird LE, Gilman AG (2001). Goodman & Gilman's The Pharmacological Basis of Therapeutics (10. изд.). New York: McGraw-Hill. ISBN 0071354697. doi:10.1036/0071422803.
- Thomas L. Lemke; David A. Williams, ур. (2007). Foye's Principles of Medicinal Chemistry (6. изд.). Baltimore: Lippincott Willams & Wilkins. ISBN 0781768799.
Spoljašnje veze
уреди
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