(2S,3S,4R)-2-(Hexacosanoylamino)-3,4-dihydroxyicosyl (1S,2R,3S,4S,5R,6R)-2,3,4,5-tetrahydroxy-6-{[6-O-(hydroxy{[(1S,2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl]oxy}phosphoryl)-α-D-mannopyrano syl]oxy}cyclohexyl hydrogen phosphate

More details:

• Systematic name

  (2S,3S,4R)-2-(Hexacosanoylamino)-3,4-dihydroxyicosyl (1S,2R,3S,4S,5R,6R)-2,3,4,5-tetrahydroxy-6-{[6-O-(hydroxy{[(1S,2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl]oxy}phosphoryl)-alpha-D-mannopyrano syl]oxy}cyclohexyl hydrogen phosphate

• SMILES

  CCCCCCCCCCCCCCCC[C@@H](O)[C@@H](O)[C@H](COP(O)(=O)O[C@@H]1[C@H](O[C@H]2O[C@H](COP(O)(=O)O[C@@H]3[C@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@H](O)[C@H]1O)NC(=O)CCCCCCCCCCCCCCCCCCCCCCCCC

• Std. InChi

  InChI=1S/C64H125NO25P2/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-29-31-33-35-37-39-41-47(67)65-44(48(68)45(66)40-38-36-34-32-30-28-18-16-14-12-10-8-6-4-2)42-85-91(81,82)90-63-59(79)55(75)54(74)58(78)62(63)88-64-60(80)50(70)49(69)46(87-64)43-86-92(83,84)89-61-56(76)52(72)51(71)53(73)57(61)77/h44-46,48-64,66,68-80H,3-43H2,1-2H3,(H,65,67)(H,81,82)(H,83,84)/t44-,45+,46+,48-,49+,50-,51-,52-,53+,54-,55-,56+,57+,58+,59+,60-,61-,62+,63-,64+/m0/s1

• Std. InChIKey

  UWURVIZGOYZCSQ-IPQZPHGMSA-N

• Cite this record

  CSID:113381782, http://www.chemspider.com/Chemical-Structure.113381782.html (accessed 08:21, Jun 3, 2024)