Concept information
Preferred term
(3r,4s,5s,6r)-6-[[(2r,3r,4s,5r,6r)-4-[(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]oxy-3,5-dihydroxy-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]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)24(51)32(61-7)57-5-11-16(43)22(49)25(52)33(64-11)58-6-12-18(45)30(27(54)34(65-12)59-4-10-15(42)19(46)23(50)31(56)60-10)67-36-28(55)29(17(44)9(3-39)63-36)66-35-26(53)21(48)14(41)8(2-38)62-35/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
- UMSVNZBVDZGLHX-YLWOMAAJSA-N
mass
- 990.861
monoisotopicmass
- 990.32751
smiles
- O([C@H]1[C@H](O)[C@H](O[C@@H](OC[C@H]2OC(O)[C@H](O)[C@@H](O)[C@@H]2O)[C@@H]1O)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)[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->3)-[beta-D-gluco-hexopyranosyl-(1->6)-beta-D-gluco-hexopyranosyl-(1->6)]-beta-D-gluco-hexopyranosyl-(1->6)-D-gluco-hexopyranose
- Glc(b1-3)Glc(b1-3)[Glc(b1-6)Glc(b1-6)]Glc(b1-6)Glc
- WURCS=2.0/2,6,5/[a2122h-1x_1-5][a2122h-1b_1-5]/1-2-2-2-2-2/a6-b1_b3-c1_b6-e1_c3-d1_e6-f1
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:155554
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