Concept information
Preferred term
n-[(2r,3r,4r,5s,6r)-4-hydroxy-6-(hydroxymethyl)-5-[(2s,3r,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2-[[(2r,3r,4s,5r,6s)-3,4,5-trihydroxy-6-[(2r,3r,4r,5s)-1,2,4,5,6-pentahydroxyhexan-3-yl]oxyoxan-2-yl]methoxy]oxan-3-yl]acetamide
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C26H47NO21
inchi
- InChI=1S/C26H47NO21/c1-7(32)27-13-17(38)23(48-25-20(41)18(39)15(36)10(4-30)44-25)11(5-31)45-24(13)43-6-12-16(37)19(40)21(42)26(46-12)47-22(9(34)3-29)14(35)8(33)2-28/h8-26,28-31,33-42H,2-6H2,1H3,(H,27,32)/t8-,9+,10+,11+,12+,13+,14+,15-,16-,17+,18-,19-,20+,21+,22+,23+,24+,25-,26-/m0/s1
inchikey
- JEMKQRAPSFRBCX-DYMPEBHRSA-N
mass
- 709.648
monoisotopicmass
- 709.26406
smiles
- O1[C@@H]([C@@H](O[C@@H]2O[C@@H]([C@H](O)[C@H](O)[C@H]2O)CO)[C@H](O)[C@@H](NC(=O)C)[C@@H]1OC[C@H]3O[C@@H](O[C@@H]([C@H](O)[C@@H](O)CO)[C@H](O)CO)[C@H](O)[C@@H](O)[C@H]3O)CO
subset
- 2_STAR
synonym RELATED
- WURCS=2.0/3,4,3/[h2122h][a2112h-1b_1-5][a2122h-1b_1-5_2*NCC/3=O]/1-2-3-2/a4-b1_b6-c1_c4-d1
In other languages
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:152533
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