Concept information
Preferred term
(2r,3r,4s,5s,6r)-2-[(2s,3r,4s,5r,6r)-2-[[(2r,3s,4s,5r,6s)-6-[[(2r,3r,4s,5r)-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-3,5,6-trihydroxyoxan-2-yl]methoxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-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(47)22(54)27(59)40(72-8)77-34-19(51)10(3-45)70-38(31(34)63)67-5-12-17(49)24(56)26(58)37(74-12)66-7-14-21(53)33(30(62)36(65)69-14)76-42-29(61)25(57)18(50)13(75-42)6-68-39-32(64)35(20(52)11(4-46)71-39)78-41-28(60)23(55)16(48)9(2-44)73-41/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
- YCUPSVSXALWCCD-LJBHGBGUSA-N
mass
- 1153.002
monoisotopicmass
- 1152.38033
smiles
- O([C@H]1[C@H](O)[C@H](OC(O)[C@@H]1O)CO[C@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)CO[C@H]3O[C@@H]([C@@H](O)[C@H](O[C@H]4O[C@@H]([C@@H](O)[C@H](O)[C@H]4O)CO)[C@H]3O)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]7O[C@@H]([C@@H](O)[C@H](O)[C@H]7O)CO)[C@H]6O)CO
subset
- 2_STAR
synonym RELATED
- alpha-D-gluco-hexopyranosyl-(1->3)-alpha-D-gluco-hexopyranosyl-(1->6)-alpha-D-gluco-hexopyranosyl-(1->3)-[alpha-D-gluco-hexopyranosyl-(1->3)-alpha-D-gluco-hexopyranosyl-(1->6)-alpha-D-gluco-hexopyranosyl-(1->6)]-D-gluco-hexopyranose
- Glc(a1-3)Glc(a1-6)Glc(a1-3)[Glc(a1-3)Glc(a1-6)Glc(a1-6)]Glc
- WURCS=2.0/2,7,6/[a2122h-1x_1-5][a2122h-1a_1-5]/1-2-2-2-2-2-2/a3-b1_a6-e1_b6-c1_c3-d1_e6-f1_f3-g1
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:155707
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