Concept information
Preferred term
(2r,3r,4s,5r,6r)-4-[(2s,3r,4s,5r,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]-3,5-dihydroxy-4-[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-[[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyoxan-2-yl]oxy-6-(hydroxymethyl)oxane-2,3,5-triol
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C36H62O31
inchi
- InChI=1S/C36H62O31/c37-1-7-13(41)19(47)22(50)32(60-7)57-5-11-15(43)21(49)24(52)35(63-11)67-30-18(46)12(64-36(27(30)55)65-28-16(44)9(3-39)59-31(56)25(28)53)6-58-33-26(54)29(17(45)10(4-40)61-33)66-34-23(51)20(48)14(42)8(2-38)62-34/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
- PJBITGZUNCZYCH-JTALRCHASA-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]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)CO)[C@@H](O)[C@@H]1O[C@H]4[C@H](O)[C@H](O[C@@H](O)[C@@H]4O)CO)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->6)-beta-D-gluco-hexopyranosyl-(1->3)-[beta-D-gluco-hexopyranosyl-(1->3)-beta-D-gluco-hexopyranosyl-(1->6)]-beta-D-gluco-hexopyranosyl-(1->3)-beta-D-gluco-hexopyranose
- Glc(b1-6)Glc(b1-3)[Glc(b1-3)Glc(b1-6)]Glc(b1-3)b-Glc
- WURCS=2.0/1,6,5/[a2122h-1b_1-5]/1-1-1-1-1-1/a3-b1_b3-c1_b6-e1_c6-d1_e3-f1
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:155144
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