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Chemistry, part 3

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > oxygen molecular entity > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > oligosaccharide derivative > beta-d-glcnac-(1->3)-alpha-d-glcn-(1->4)-[alpha-ld-hep-(1->2)-alpha-dd-hep-(1->2)]-alpha-d-gala-(1->3)-[beta-d-galan-(1->7)-alpha-ld-hep-(1->7)]-alpha-ld-hep6petn-(1->3)-[beta-d-glc-(1->4)]-alpha-ld-hep-(1->5)-[alpha-kdo-(2->4)][beta-l-arap4n-(1->8)]-alpha-kdo
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > organochalcogen compound > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > oligosaccharide derivative > beta-d-glcnac-(1->3)-alpha-d-glcn-(1->4)-[alpha-ld-hep-(1->2)-alpha-dd-hep-(1->2)]-alpha-d-gala-(1->3)-[beta-d-galan-(1->7)-alpha-ld-hep-(1->7)]-alpha-ld-hep6petn-(1->3)-[beta-d-glc-(1->4)]-alpha-ld-hep-(1->5)-[alpha-kdo-(2->4)][beta-l-arap4n-(1->8)]-alpha-kdo
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > heteroorganic entity > organochalcogen compound > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > oligosaccharide derivative > beta-d-glcnac-(1->3)-alpha-d-glcn-(1->4)-[alpha-ld-hep-(1->2)-alpha-dd-hep-(1->2)]-alpha-d-gala-(1->3)-[beta-d-galan-(1->7)-alpha-ld-hep-(1->7)]-alpha-ld-hep6petn-(1->3)-[beta-d-glc-(1->4)]-alpha-ld-hep-(1->5)-[alpha-kdo-(2->4)][beta-l-arap4n-(1->8)]-alpha-kdo
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > oxygen molecular entity > organooxygen compound > carbohydrates and carbohydrate derivatives > glycan > oligosaccharide derivative > beta-d-glcnac-(1->3)-alpha-d-glcn-(1->4)-[alpha-ld-hep-(1->2)-alpha-dd-hep-(1->2)]-alpha-d-gala-(1->3)-[beta-d-galan-(1->7)-alpha-ld-hep-(1->7)]-alpha-ld-hep6petn-(1->3)-[beta-d-glc-(1->4)]-alpha-ld-hep-(1->5)-[alpha-kdo-(2->4)][beta-l-arap4n-(1->8)]-alpha-kdo
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > organochalcogen compound > organooxygen compound > carbohydrates and carbohydrate derivatives > glycan > oligosaccharide derivative > beta-d-glcnac-(1->3)-alpha-d-glcn-(1->4)-[alpha-ld-hep-(1->2)-alpha-dd-hep-(1->2)]-alpha-d-gala-(1->3)-[beta-d-galan-(1->7)-alpha-ld-hep-(1->7)]-alpha-ld-hep6petn-(1->3)-[beta-d-glc-(1->4)]-alpha-ld-hep-(1->5)-[alpha-kdo-(2->4)][beta-l-arap4n-(1->8)]-alpha-kdo
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > heteroorganic entity > organochalcogen compound > organooxygen compound > carbohydrates and carbohydrate derivatives > glycan > oligosaccharide derivative > beta-d-glcnac-(1->3)-alpha-d-glcn-(1->4)-[alpha-ld-hep-(1->2)-alpha-dd-hep-(1->2)]-alpha-d-gala-(1->3)-[beta-d-galan-(1->7)-alpha-ld-hep-(1->7)]-alpha-ld-hep6petn-(1->3)-[beta-d-glc-(1->4)]-alpha-ld-hep-(1->5)-[alpha-kdo-(2->4)][beta-l-arap4n-(1->8)]-alpha-kdo

Preferred term

beta-d-glcnac-(1->3)-alpha-d-glcn-(1->4)-[alpha-ld-hep-(1->2)-alpha-dd-hep-(1->2)]-alpha-d-gala-(1->3)-[beta-d-galan-(1->7)-alpha-ld-hep-(1->7)]-alpha-ld-hep6petn-(1->3)-[beta-d-glc-(1->4)]-alpha-ld-hep-(1->5)-[alpha-kdo-(2->4)][beta-l-arap4n-(1->8)]-alpha-kdo  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C90H152N5O76P

inchi

  • InChI=1S/C90H152N5O76P/c1-17(103)95-33-40(117)36(113)27(10-100)150-78(33)157-63-29(12-102)152-77(32(94)39(63)116)161-67-54(131)71(165-85-70(48(125)47(124)58(155-85)21(106)7-97)164-82-52(129)43(120)45(122)57(154-82)20(105)6-96)86(167-73(67)75(136)137)160-66-53(130)64(30(171-172(143,144)149-3-2-91)16-148-80-50(127)42(119)46(123)59(153-80)24(109)14-146-76-31(93)38(115)44(121)69(163-76)74(134)135)158-83(55(66)132)162-68-56(133)84(156-61(23(108)9-99)72(68)166-81-51(128)41(118)37(114)28(11-101)151-81)159-65-26(168-90(88(140)141)4-19(104)35(112)60(170-90)22(107)8-98)5-89(142,87(138)139)169-62(65)25(110)15-147-79-49(126)34(111)18(92)13-145-79/h18-73,76-86,96-102,104-133,142H,2-16,91-94H2,1H3,(H,95,103)(H,134,135)(H,136,137)(H,138,139)(H,140,141)(H,143,144)/t18-,19+,20-,21+,22+,23-,24-,25+,26+,27+,28+,29+,30-,31+,32+,33+,34-,35+,36+,37+,38+,39+,40+,41-,42-,43-,44+,45-,46-,47-,48-,49+,50-,51+,52-,53+,54-,55-,56-,57+,58+,59+,60+,61+,62+,63+,64+,65+,66-,67+,68+,69-,70-,71+,72+,73-,76+,77+,78-,79+,80-,81-,82+,83+,84+,85+,86-,89+,90+/m0/s1

inchikey

  • LXLACIFFOQTXIZ-NBNXSLGKSA-N

mass

  • 2551.135

monoisotopicmass

  • 2549.79205

smiles

  • O[C@@H]1[C@H]([C@H](O[C@@H]([C@@H]1O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)NC(C)=O)O)N)C(O)=O)O[C@@H]4[C@H](O)[C@H](O[C@@]([C@H]4O)([C@@H](OP(=O)(OCCN)O)CO[C@H]5O[C@@]([C@H]([C@@H]([C@@H]5O)O)O)([C@@H](O)CO[C@H]6[C@@H]([C@H]([C@H]([C@H](O6)C(O)=O)O)O)N)[H])[H])O[C@@H]7[C@H](O)[C@H](O[C@@]([C@H]7O[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O)([C@@H](O)CO)[H])O[C@@H]9[C@@H](C[C@@](O[C@@]9([C@H](O)CO[C@@H]%10[C@@H]([C@H]([C@H](CO%10)N)O)O)[H])(C(O)=O)O)O[C@@]%11(C[C@H]([C@H]([C@](O%11)([C@H](O)CO)[H])O)O)C(O)=O)O[C@H]%12O[C@@]([C@H]([C@@H]([C@@H]%12O[C@H]%13O[C@@]([C@H]([C@@H]([C@@H]%13O)O)O)([C@@H](O)CO)[H])O)O)([C@H](O)CO)[H]

subset

  • 3_STAR

synonym EXACT

  • 2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-amino-2-deoxy-alpha-D-glucopyranosyl-(1->4)-[L-glycero-alpha-D-manno-heptopyranosyl-(1->2)-D-glycero-alpha-D-manno-heptopyranosyl-(1->2)]-alpha-D-galactopyranuronosyl-(1->3)-[2-amino-2-deoxy-beta-D-galactopyranuronosyl-(1->7)-L-glycero-alpha-D-manno-heptopyranosyl-(1->7)]-6-O-[(2-aminoethoxy)(hydroxy)phosphoryl]-L-glycero-alpha-D-manno-heptopyranosyl-(1->3)-[beta-D-glucopyranosyl-(1->4)]-L-glycero-alpha-D-manno-heptopyranosyl-(1->5)-[4-amino-4-deoxy-beta-L-arabinopyranosyl-(1->8)]-[3-deoxy-alpha-D-manno-oct-2-ulopyranonosyl-(2->4)]-3-deoxy-alpha-D-manno-oct-2-ulopyranosonic acid

synonym RELATED

  • beta-D-GlcpNAc-(1->3)-alpha-D-GlcpN-(1->4)-[alpha-LD-Hepp-(1->2)-alpha-DD-Hepp-(1->2)]-alpha-D-GalpA-(1->3)-[beta-D-GalpAN-(1->7)-alpha-LD-Hepp-(1->7)]-alpha-LD-Hepp6PEtn-(1->3)-[beta-D-Glcp-(1->4)]-alpha-LD-Hepp-(1->5)-[alpha-Kdo-(2->4)][beta-L-Arap4N-(1->8)]-alpha-Kdo
  • beta-GlcNAc-(1->3)-alpha-GlcN-(1->4)-[alpha-Hep-(1->2)-alpha-DD-Hep-(1->2)]-alpha-GalA-(1->3)-[beta-GalAN-(1->7)-alpha-Hep-(1->7)]-alpha-Hep6PEtn-(1->3)-[beta-Glc-(1->4)]-alpha-Hep-(1->5)-[alpha-Kdo-(2->4)][beta-L-Ara4N-(1->8)]-alpha-Kdo
  • P. Penneri 37 and 44 LPS core oligosaccharide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:134697

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