Concept information
Preferred term
n-[(2s,3r,4r,5s,6r)-2-[(2r,3s,4s,5s,6s)-5-[(2s,3r,4r,5s,6r)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-hydroxy-2-(hydroxymethyl)-6-[[(2r,3s,4s,5s)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy]oxan-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C28H48N2O21
inchi
- InChI=1S/C28H48N2O21/c1-7(34)29-13-18(39)15(36)9(3-31)47-26(13)50-23-11(5-33)49-28(45-6-12-17(38)20(41)21(42)25(44)46-12)24(22(23)43)51-27-14(30-8(2)35)19(40)16(37)10(4-32)48-27/h9-28,31-33,36-44H,3-6H2,1-2H3,(H,29,34)(H,30,35)/t9-,10-,11-,12-,13-,14-,15-,16-,17-,18-,19-,20+,21+,22+,23-,24+,25?,26+,27+,28+/m1/s1
inchikey
- AOBVLGIBWFZRTQ-KOSKOLCZSA-N
mass
- 748.685
monoisotopicmass
- 748.27496
smiles
- O([C@H]1[C@H](O)[C@H](O[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2NC(=O)C)CO)[C@H](O[C@@H]1CO)OC[C@H]3OC(O)[C@@H](O)[C@@H](O)[C@@H]3O)[C@@H]4O[C@@H]([C@@H](O)[C@H](O)[C@H]4NC(=O)C)CO
subset
- 2_STAR
synonym RELATED
- 2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->2)-[2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->4)]-alpha-D-manno-hexopyranosyl-(1->6)-D-manno-hexopyranose
- GlcNAc(b1-2)[GlcNAc(b1-4)]Man(a1-6)Man
- WURCS=2.0/3,4,3/[a1122h-1x_1-5][a1122h-1a_1-5][a2122h-1b_1-5_2*NCC/3=O]/1-2-3-3/a6-b1_b2-c1_b4-d1
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:151802
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