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118013-66-4 citotossina tracheale, Bordetella pertussis

Nome del prodotto citotossina tracheale, Bordetella pertussis
Sinonimi ;(2S,5S,10R,13S,16R)-16-{[(1S,3R,4R,5S)-4-(acetilammino)-2-{[(2S,3R,4R,5S,6R)-3-(acetilammino)-4,5-diidrossi-6-(idrossimetil)tetraidro-2H-pirano-2-il]ossi}-6,8-diossabiciclo[3.2.1]ott-3-il]ossi}-5-[(4R)-4-ammino-4-carbossibutil]-10-carbossi-2,13-dimetil-4,7,12,15-tetraosso-3,6,11,14-tetraazaheptadecano-1-oico (nome non preferito); acido (2R,5S,10R,13S,16R)-16-{[(1R,2S,3R,4R,5R)-4-(acetilammino)-2-{[(2S,3R,4R,5S,6R)-3-(acetilammino)-4,5-diidrossi-6-(idrossimetil)tetraidro-2H-pirano-2-il]ossi}-6,8-diossabiciclo[3.2.1]ott-3-il]ossi}-5-[(4R)-4-ammino-4-carbossibutil]-10-carbossi-2,13-dimetil-4,7,12,15-tetraosso-3,6,11,14-tetraazaheptadecano-1-oico (denominazione non preferita)
Nome inglese tracheal cytotoxin, Bordetella pertussis; (2S,5S,10R,13S,16R)-16-{[(1S,3R,4R,5S)-4-(acetylamino)-2-{[(2S,3R,4R,5S,6R)-3-(acetylamino)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]oxy}-6,8-dioxabicyclo[3.2.1]oct-3-yl]oxy}-5-[(4R)-4-amino-4-carboxybutyl]-10-carboxy-2,13-dimethyl-4,7,12,15-tetraoxo-3,6,11,14-tetraazaheptadecan-1-oic acid (non-preferred name); (2R,5S,10R,13S,16R)-16-{[(1R,2S,3R,4R,5R)-4-(acetylamino)-2-{[(2S,3R,4R,5S,6R)-3-(acetylamino)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]oxy}-6,8-dioxabicyclo[3.2.1]oct-3-yl]oxy}-5-[(4R)-4-amino-4-carboxybutyl]-10-carboxy-2,13-dimethyl-4,7,12,15-tetraoxo-3,6,11,14-tetraazaheptadecan-1-oic acid (non-preferred name)
Formula molecolare C37H59N7O20
Peso Molecolare 921.8993
InChI InChI=1/C37H59N7O20/c1-13(30(51)44-20(35(58)59)9-10-23(48)43-19(8-6-7-18(38)34(56)57)32(53)40-14(2)33(54)55)39-31(52)15(3)61-29-25(42-17(5)47)36-60-12-22(63-36)28(29)64-37-24(41-16(4)46)27(50)26(49)21(11-45)62-37/h13-15,18-22,24-29,36-37,45,49-50H,6-12,38H2,1-5H3,(H,39,52)(H,40,53)(H,41,46)(H,42,47)(H,43,48)(H,44,51)(H,54,55)(H,56,57)(H,58,59)/t13-,14+,15+,18+,19-,20+,21+,22+,24+,25+,26+,27+,28+,29+,36+,37-/m0/s1
Numero CAS 118013-66-4
Struttura molecolare 118013-66-4 citotossina tracheale, Bordetella pertussis
Densità 1.49g/cm3
Punto di ebollizione 1400.2°C at 760 mmHg 
Indice di rifrazione 1.602 
Punto d'infiammabilità 800.6°C 
Pressione di vapore 0mmHg at 25°C
Simboli di pericolo
Codici di Rischio
Sicurezza Descrizione