Concept information
Preferred term
(2r,3r,4s,5s,6r)-2-[[(2r,3s,4s,5r,6r)-6-[[(2r,3r,4s,5r,6r)-4-[(2s,3r,4s,5r,6r)-3,5-dihydroxy-6-(hydroxymethyl)-4-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-[[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-[[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxymethyl]oxan-2-yl]oxyoxan-2-yl]oxy-3,5,6-trihydroxyoxan-2-yl]methoxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C42H72O36
inchi
- InChI=1S/C42H72O36/c43-1-8-15(46)22(53)27(58)37(71-8)66-4-11-17(48)24(55)29(60)39(74-11)68-6-13-19(50)26(57)31(62)41(76-13)78-35-20(51)10(3-45)73-42(33(35)64)77-34-21(52)14(70-36(65)32(34)63)7-69-40-30(61)25(56)18(49)12(75-40)5-67-38-28(59)23(54)16(47)9(2-44)72-38/h8-65H,1-7H2/t8-,9-,10-,11-,12-,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+/m1/s1
inchikey
- UIIUKYAVIWLAQV-KUMXDEOLSA-N
mass
- 1153.002
monoisotopicmass
- 1152.38033
smiles
- O([C@@H]1[C@@H](O)[C@H](O[C@H]2[C@H](O)[C@H](O[C@@H](O)[C@@H]2O)CO[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)CO[C@@H]4O[C@@H]([C@@H](O)[C@H](O)[C@H]4O)CO)O[C@@H]([C@H]1O)CO)[C@@H]5O[C@@H]([C@@H](O)[C@H](O)[C@H]5O)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)CO
subset
- 2_STAR
synonym RELATED
- beta-D-gluco-hexopyranosyl-(1->6)-beta-D-gluco-hexopyranosyl-(1->6)-beta-D-gluco-hexopyranosyl-(1->3)-beta-D-gluco-hexopyranosyl-(1->3)-[beta-D-gluco-hexopyranosyl-(1->6)-beta-D-gluco-hexopyranosyl-(1->6)]-beta-D-gluco-hexopyranose
- Glc(b1-6)Glc(b1-6)Glc(b1-3)Glc(b1-3)[Glc(b1-6)Glc(b1-6)]b-Glc
- WURCS=2.0/1,7,6/[a2122h-1b_1-5]/1-1-1-1-1-1-1/a3-b1_a6-f1_b3-c1_c6-d1_d6-e1_f6-g1
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:148077
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