Concept information
Preferred term
(3r,4s,5r,6r)-4-[(2r,3r,4s,5s,6r)-6-[[(2s,3r,4s,5r,6r)-3,5-dihydroxy-6-(hydroxymethyl)-4-[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-6-(hydroxymethyl)oxane-2,3,5-triol
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C24H42O21
inchi
- InChI=1S/C24H42O21/c25-1-5-9(28)13(32)15(34)23(42-5)45-20-12(31)7(3-27)41-22(18(20)37)39-4-8-10(29)14(33)16(35)24(43-8)44-19-11(30)6(2-26)40-21(38)17(19)36/h5-38H,1-4H2/t5-,6-,7-,8-,9-,10-,11-,12-,13+,14+,15-,16-,17-,18-,19+,20+,21?,22+,23-,24-/m1/s1
inchikey
- QPQUTUZBCHVDDD-GHUWGGCHSA-N
mass
- 666.579
monoisotopicmass
- 666.22186
smiles
- O([C@@H]1[C@@H](O)[C@H](O[C@@H]([C@H]1O)CO)OC[C@H]2O[C@H](O[C@H]3[C@H](O)[C@H](OC(O)[C@@H]3O)CO)[C@H](O)[C@@H](O)[C@@H]2O)[C@H]4O[C@@H]([C@@H](O)[C@H](O)[C@H]4O)CO
subset
- 2_STAR
synonym RELATED
- alpha-D-gluco-hexopyranosyl-(1->3)-alpha-D-gluco-hexopyranosyl-(1->6)-alpha-D-gluco-hexopyranosyl-(1->3)-D-gluco-hexopyranose
- Glc(a1-3)Glc(a1-6)Glc(a1-3)Glc
- WURCS=2.0/2,4,3/[a2122h-1x_1-5][a2122h-1a_1-5]/1-2-2-2/a3-b1_b6-c1_c3-d1
In other languages
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:150794
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