Concept information
Preferred term
(2s,3r,4s,5s,6r)-6-[[(2r,3r,4s,5r,6r)-6-[[(2r,3r,4s,5s,6r)-6-[[(2r,3r,4s,5r,6r)-3,5-dihydroxy-6-(hydroxymethyl)-4-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxymethyl]-3,5-dihydroxy-4-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxymethyl]oxane-2,3,4,5-tetrol
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C36H62O31
inchi
- InChI=1S/C36H62O31/c37-1-7-13(40)20(47)25(52)35(62-7)66-29-17(44)9(3-39)61-33(27(29)54)59-5-11-16(43)22(49)24(51)32(64-11)57-6-12-18(45)30(67-36-26(53)21(48)14(41)8(2-38)63-36)28(55)34(65-12)58-4-10-15(42)19(46)23(50)31(56)60-10/h7-56H,1-6H2/t7-,8-,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+/m1/s1
inchikey
- UAFJZFYNOFUYHC-ZDXFVUQUSA-N
mass
- 990.861
monoisotopicmass
- 990.32751
smiles
- O1[C@@H]([C@@H](O)[C@H](O[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)CO)[C@@H](O)[C@@H]1OC[C@H]3O[C@H](O)[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[C@@H]5O[C@@H]([C@@H](O)[C@H](O[C@@H]6O[C@@H]([C@@H](O)[C@H](O)[C@H]6O)CO)[C@H]5O)CO
subset
- 2_STAR
synonym RELATED
- beta-D-gluco-hexopyranosyl-(1->3)-beta-D-gluco-hexopyranosyl-(1->6)-beta-D-gluco-hexopyranosyl-(1->6)-[beta-D-gluco-hexopyranosyl-(1->3)]-beta-D-gluco-hexopyranosyl-(1->6)-alpha-D-gluco-hexopyranose
- Glc(b1-3)Glc(b1-6)Glc(b1-6)[Glc(b1-3)]Glc(b1-6)a-Glc
- WURCS=2.0/2,6,5/[a2122h-1a_1-5][a2122h-1b_1-5]/1-2-2-2-2-2/a6-b1_b3-c1_b6-d1_d6-e1_e3-f1
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:149041
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