CAS Number
Molecular Formula
C31H53N3O49S8
Product format
Neat
Molecular Weight
1508.3
API Family
Synonyms
Fondaparinux; 104993-28-4; Heparin pentasaccharide; Natural heparin pentasaccharide; ORG31540 free acid; ORG-31540 free acid; J177FOW5JL; CHEBI:61033; SR 901107A; SR-901107A; DTXSID10146903; methyl 2-deoxy-6-O-sulfo-2-(sulfoamino)-alpha-D-glucopyranosyl-(1->4)-beta-D-glucopyranuronosyl-(1->4)-2-deoxy-3, 6-di-O-sulfo-2-(sulfoamino)-alpha-D-glucopyranosyl-(1->4)-2-O-sulfo-alpha-L-idopyranuronosyl-(1->4)-2-deoxy-6-O-sulfo-2-(sulfoamino)-alpha-D-glucopyranoside; IC 85158; RefChem:55228; DTXCID9069394; CHEBI:139212; (2R, 3S, 4S, 5R, 6R)-3-(((2R, 3R, 4R, 5R, 6R)-5-(((2R, 3R, 4R, 5S, 6S)-6-carboxy-5-(((2R, 3R, 4R, 5S, 6R)-4, 5-dihydroxy-3-(sulfoamino)-6-((sulfooxy)methyl)oxan-2-yl)oxy)-3, 4-dihydroxyoxan-2-yl)oxy)-3-(sulfoamino)-4-(sulfooxy)-6-((sulfooxy)methyl)oxan-2-yl)oxy)-4-hydroxy-6-(((2R, 3S, 4R, 5R, 6S)-4-hydroxy-6-methoxy-5-(sulfoamino)-2-((sulfooxy)methyl)oxan-3-yl)oxy)-5-(sulfooxy)oxane-2-carboxylic acid; (2S, 3S, 4R, 5R, 6R)-6-((2R, 3R, 4R, 5R, 6R)-6-((2R, 3S, 4S, 5R, 6R)-2-carboxy-4-hydroxy-6-((2R, 3S, 4R, 5R, 6S)-4-hydroxy-6-methoxy-5-(sulfoamino)-2-(sulfooxymethyl)oxan-3-yl)oxy-5-sulfooxyoxan-3-yl)oxy-5-(sulfoamino)-4-sulfooxy-2-(sulfooxymethyl)oxan-3-yl)oxy-3-((2R, 3R, 4R, 5S, 6R)-4, 5-dihydroxy-3-(sulfoamino)-6-(sulfooxymethyl)oxan-2-yl)oxy-4 and 5-dihydroxyoxane-2-carboxylic acid; UNII-J177FOW5JL; SR 90107
Iupac Name
(2S, 3S, 4R, 5R, 6R)-6-[(2R, 3R, 4R, 5R, 6R)-6-[(2R, 3S, 4S, 5R, 6R)-2-carboxy-4-hydroxy-6-[(2R, 3S, 4R, 5R, 6S)-4-hydroxy-6-methoxy-5-(sulfoamino)-2-(sulfooxymethyl)oxan-3-yl]oxy-5-sulfooxyoxan-3-yl]oxy-5-(sulfoamino)-4-sulfooxy-2-(sulfooxymethyl)oxan-3-yl]oxy-3-[(2R, 3R, 4R, 5S, 6R)-4, 5-dihydroxy-3-(sulfoamino)-6-(sulfooxymethyl)oxan-2-yl]oxy-4 and 5-dihydroxyoxane-2-carboxylic acid
InChI
InChI=1S/C31H53N3O49S8/c1-69-27-9(33-85(48,49)50)13(37)17(6(74-27)3-71-88(57,58)59)76-31-22(83-91(66,67)68)16(40)21(24(81-31)26(43)44)79-29-10(34-86(51,52)53)19(82-90(63,64)65)18(7(75-29)4-72-89(60,61)62)77-30-15(39)14(38)20(23(80-30)25(41)42)78-28-8(32-84(45,46)47)12(36)11(35)5(73-28)2-70-87(54,55)56/h5-24,27-40H,2-4H2,1H3,(H,41,42)(H,43,44)(H,45,46,47)(H,48,49,50)(H,51,52,53)(H,54,55,56)(H,57,58,59)(H,60,61,62)(H,63,64,65)(H,66,67,68)/t5-,6-,7-,8-,9-,10-,11-,12-,13-,14-,15-,16+,17-,18-,19-,20+,21+,22-,23+,24-,27+,28-,29-,30-,31-/m1/s1
