Sulfatid

Sulfatid
Identifikacija
PubChem	5459389
DrugBank	DB04780
Jmol-3D slike	Slika 1
SMILES
	CCCCCCCCCCCCCCCCCCCCCC[C@@H](O)C(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](OS(O)(=O)=O)[C@H]1O)[C@H](O)\C=C\CCCCCCCCCCCCC
InChI
	InChI=1S/C48H93NO12S/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-25-27-29-31-33-35-37-42(52)47(55)49-40(41(51)36-34-32-30-28-26-24-16-14-12-10-8-6-4-2)39-59-48-45(54)46(61-62(56,57)58)44(53)43(38-50)60-48/h34,36,40-46,48,50-54H,3-33,35,37-39H2,1-2H3,(H,49,55)(H,56,57,58)/b36-34 /t40-,41 ,42 ,43 ,44-,45 ,46-,48 /m0/s1 ; Kod: QTTLKKFUOJQIRB-JOLIRYOJSA-N
Svojstva
Molekulska formula	C48H93NO12S
Molarna masa	908.32 g mol−1
	(šta je ovo?) (verifikuj) ; Ukoliko nije drugačije napomenuto, podaci se odnose na standardno stanje (25 °C, 100 kPa) materijala
	Infobox references

Sulfatidi su klasa sulfatisanih galaktozilceramida koji se prvenstveno sintetišu u oligodendrocitima u centralnom nervnom sistemu. Sulfatidi su tip sulfolipida.^[3]^[4]

Klinički značaj

Alteracije sulfatidnog metabolizma, razmena i homeostaza su prisutni u najranijim klinički prepoznatljivim stepenima Alchajmerove bolesti i vezani su za metahromatsku leukodistrofiju (MLD).

Osobine

Osobina	Vrednost
Broj akceptora vodonika	12
Broj donora vodonika	7
Broj rotacionih veza	43
Particioni koeficijent^[5] (ALogP)	12,3
Rastvorljivost^[6] (logS, log(mol/L))	-17,2
Polarna površina^[7] (PSA, Å²)	220,7

Povezano

Sulfatidoza

Literatura

↑ Li Q, Cheng T, Wang Y, Bryant SH (2010). „PubChem as a public resource for drug discovery.”. Drug Discov Today 15 (23-24): 1052-7. DOI:10.1016/j.drudis.2010.10.003. PMID 20970519. edit
↑ Evan E. Bolton, Yanli Wang, Paul A. Thiessen, Stephen H. Bryant (2008). „Chapter 12 PubChem: Integrated Platform of Small Molecules and Biological Activities”. Annual Reports in Computational Chemistry 4: 217-241. DOI:10.1016/S1574-1400(08)00012-1.
↑ Michael A Lieberman, Rick Ricer (2010). Lippincott's Illustrated Q&A Review of Biochemistry (1 Pap/Psc ed izd.). Lippincott Williams & Wilkins. ISBN 1605473022.
↑ Huang JQ, Trasler JM, Igdoura S, Michaud J, Hanal N, Gravel RA (October 1997). „Apoptotic cell death in mouse models of GM2 gangliosidosis and observations on human Tay-Sachs and Sandhoff diseases”. Human molecular genetics 6 (11): 1879–85. DOI:10.1093/hmg/6.11.1879. PMID 9302266.
↑ Ghose, A.K., Viswanadhan V.N., and 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. DOI:10.1021/ci000392t. PMID 11749573.
↑ 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. DOI:10.1021/jm000942e. PMID 11020286.

Spoljašnje veze

Portal Hemija

MeSH Sulfatides

[1] Li Q, Cheng T, Wang Y, Bryant SH (2010). „PubChem as a public resource for drug discovery.”. Drug Discov Today 15 (23-24): 1052-7. DOI:10.1016/j.drudis.2010.10.003. PMID 20970519. edit

[2] Evan E. Bolton, Yanli Wang, Paul A. Thiessen, Stephen H. Bryant (2008). „Chapter 12 PubChem: Integrated Platform of Small Molecules and Biological Activities”. Annual Reports in Computational Chemistry 4: 217-241. DOI:10.1016/S1574-1400(08)00012-1.

[3] Michael A Lieberman, Rick Ricer (2010). Lippincott's Illustrated Q&A Review of Biochemistry (1 Pap/Psc ed izd.). Lippincott Williams & Wilkins. ISBN 1605473022.

[4] Huang JQ, Trasler JM, Igdoura S, Michaud J, Hanal N, Gravel RA (October 1997). „Apoptotic cell death in mouse models of GM2 gangliosidosis and observations on human Tay-Sachs and Sandhoff diseases”. Human molecular genetics 6 (11): 1879–85. DOI:10.1093/hmg/6.11.1879. PMID 9302266.

[5] Ghose, A.K., Viswanadhan V.N., and 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.

[6] 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. DOI:10.1021/ci000392t. PMID 11749573.

[7] 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. DOI:10.1021/jm000942e. PMID 11020286.

[1]

[2]

[3]

[4]

[5]

[6]

[7]