Concept information
...
organooxygen compound
carbohydrates and carbohydrate derivatives
carbohydrate derivative
amino sugar
Preferred term
n-[(2r,3r,4r,5s,6r)-5-[(2s,3r,4r,5s,6r)-5-[(2s,3s,4s,5r,6r)-4-[(2r,3s,4s,5s,6r)-3-[(2r,3s,4s,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2s,3s,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[[(2s,3s,4s,5r,6r)-3,5-dihydroxy-4-[(2s,3s,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[[(2s,3s,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxymethyl]-3,5-dihydroxyoxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,4-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C56H95NO46
inchi
- InChI=1S/C56H95NO46/c1-11(65)57-21-29(73)42(17(7-63)89-48(21)86)98-53-39(83)35(79)43(18(8-64)95-53)99-54-41(85)45(101-55-47(34(78)26(70)15(5-61)93-55)103-56-46(33(77)25(69)16(6-62)94-56)102-52-38(82)32(76)24(68)14(4-60)92-52)28(72)20(97-54)10-88-50-40(84)44(100-51-37(81)31(75)23(67)13(3-59)91-51)27(71)19(96-50)9-87-49-36(80)30(74)22(66)12(2-58)90-49/h12-56,58-64,66-86H,2-10H2,1H3,(H,57,65)/t12-,13-,14-,15-,16-,17-,18-,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-/m1/s1
inchikey
- TZSBBYGSWLZORR-OGMRRANHSA-N
mass
- 1518.337
monoisotopicmass
- 1517.51252
smiles
- O([C@H]1[C@H](O)[C@H](O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@@H](O[C@@H]2CO)O[C@H]3[C@H](O)[C@@H](NC(=O)C)[C@@H](O[C@@H]3CO)O)[C@H]1O)CO[C@H]4O[C@@H]([C@@H](O)[C@H](O[C@H]5O[C@@H]([C@@H](O)[C@H](O)[C@@H]5O)CO)[C@@H]4O)CO[C@H]6O[C@@H]([C@@H](O)[C@H](O)[C@@H]6O)CO)[C@H]7O[C@@H]([C@@H](O)[C@H](O)[C@@H]7O[C@H]8O[C@@H]([C@@H](O)[C@H](O)[C@@H]8O[C@H]9O[C@@H]([C@@H](O)[C@H](O)[C@@H]9O)CO)CO)CO
subset
- 2_STAR
synonym RELATED
- alpha-D-manno-hexopyranosyl-(1->2)-alpha-D-manno-hexopyranosyl-(1->2)-alpha-D-manno-hexopyranosyl-(1->3)-[alpha-D-manno-hexopyranosyl-(1->3)-[alpha-D-manno-hexopyranosyl-(1->6)]-alpha-D-manno-hexopyranosyl-(1->6)]-beta-D-manno-hexopyranosyl-(1->4)-beta-D-gluco-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranose
- Man(a1-2)Man(a1-2)Man(a1-3)[Man(a1-3)[Man(a1-6)]Man(a1-6)]Man(b1-4)Glc(b1-4)b-GlcNAc
- WURCS=2.0/4,9,8/[a2122h-1b_1-5_2*NCC/3=O][a2122h-1b_1-5][a1122h-1b_1-5][a1122h-1a_1-5]/1-2-3-4-4-4-4-4-4/a4-b1_b4-c1_c3-d1_c6-g1_d2-e1_e2-f1_g3-h1_g6-i1
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:149078
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