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(2S,3S,4S,5S,6R)-6-[[(2S,3S,4S,5S,6R)-3-[(2R,3S,4S,5S,6R)-4,5-Dihydroxy-6-(hydroxymethyl)-3-[(2R,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]oxymethyl]oxane-2,3,4,5-tetrol

PropertiesImage
MNX_IDMNXM41237 Image of MNXM41237
referencechebi:151781
formulaC24H42O21
global charge0
mol weight666.579
InChIKeyKKMMOTKOMKVHGW-MQMBVPCKSA-N
InChIInChI=1S/C24H42O21/c25-1-5-9(28)14(33)18(37)22(41-5)44-20-16(35)11(30)7(3-27)43-24(20)45-19-15(34)10(29)6(2-26)42-23(19)39-4-8-12(31)13(32)17(36)21(38)40-8/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
SMILESOC[C@H]1O[C@H](O[C@@H]2[C@@H](O[C@@H]3[C@@H](OC[C@H]4O[C@H](O)[C@@H](O)[C@@H](O)[C@@H]4O)O[C@H](CO)[C@@H](O)[C@@H]3O)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O
MNX internals
InChI (mnx)InChI=1/C24H42O21/c25-1-5-9(28)14(33)18(37)22(41-5)44-20-16(35)11(30)7(3-27)43-24(20)45-19-15(34)10(29)6(2-26)42-23(19)39-4-8-12(31)13(32)17(36)21(38)40-8/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 Image of MNXM41237
SMILES (mnx)[CH2:1]([C@@H:5]1[C@@H:9]([OH:28])[C@H:14]([OH:33])[C@H:18]([OH:37])[C@@H:22]([O:44][C@H:20]2[C@@H:16]([OH:35])[C@H:11]([OH:30])[C@@H:7]([CH2:3][OH:27])[O:43][C@@H:24]2[O:45][C@H:19]2[C@@H:15]([OH:34])[C@H:10]([OH:29])[C@@H:6]([CH2:2][OH:26])[O:42][C@@H:23]2[O:39][CH2:4][C@@H:8]2[C@@H:12]([OH:31])[C@H:13]([OH:32])[C@H:17]([OH:36])[C@@H:21]([OH:38])[O:40]2)[O:41]1)[OH:25]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:151781
chebi:151781
KKMMOTKOMKVHGW-MQMBVPCKSA-N
(2S,3S,4S,5S,6R)-6-[[(2S,3S,4S,5S,6R)-3-[(2R,3S,4S,5S,6R)-4,5-Dihydroxy-6-(hydroxymethyl)-3-[(2R,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]oxymethyl]oxane-2,3,4,5-tetrol
Man(a1-2)Man(a1-2)Man(a1-6)a-Man
WURCS=2.0/1,4,3/[a1122h-1a_1-5]/1-1-1-1/a6-b1_b2-c1_c2-d1
alpha-D-manno-hexopyranosyl-(1->2)-alpha-D-manno-hexopyranosyl-(1->2)-alpha-D-manno-hexopyranosyl-(1->6)-alpha-D-manno-hexopyranose

CHEBI:61620
chebi:61620
KKMMOTKOMKVHGW-MWFILZMISA-N
alpha-D-Manp-(1->2)-alpha-D-Manp-(1->2)-alpha-D-Manp-(1->6)-D-Manp
(Man)4
WURCS=2.0/2,4,3/[a1122h-1x_1-5][a1122h-1a_1-5]/1-2-2-2/a6-b1_b2-c1_c2-d1
alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->6)-D-Man
alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->6)-D-mannopyranose
alpha-D-mannosyl-(1->2)-alpha-D-mannosyl-(1->2)-alpha-D-mannosyl-(1->6)-D-mannose