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CHEBI:143174 - D-cellohexaono-1,5-lactone

ChEBI IDCHEBI:143174
ChEBI NameD-cellohexaono-1,5-lactone
Stars
ASCII NameD-cellohexaono-1,5-lactone
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC36H60O31
Net Charge0
Average Mass988.845
Monoisotopic Mass988.31186
SMILESO=C1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O
WURCSWURCS=2.0/2,6,5/[A2122h_1-5][a2122h-1b_1-5]/1-2-2-2-2-2/a4-b1_b4-c1_c4-d1_d4-e1_e4-f1
InChIInChI=1S/C36H60O31/c37-1-7-13(43)14(44)21(51)32(58-7)64-27-9(3-39)60-34(23(53)16(27)46)66-29-11(5-41)62-36(25(55)18(29)48)67-30-12(6-42)61-35(24(54)19(30)49)65-28-10(4-40)59-33(22(52)17(28)47)63-26-8(2-38)57-31(56)20(50)15(26)45/h7-30,32-55H,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-,32+,33+,34+,35+,36+/m1/s1
InChIKeyQYBQUOGVPYOWBW-WLFNWXPVSA-N
ChEBI Ontology
Outgoing Relation(s)
D-cellohexaono-1,5-lactone (CHEBI:143174) has functional parent D-glucono-1,5-lactone (CHEBI:16217)
D-cellohexaono-1,5-lactone (CHEBI:143174) is a hexasaccharide (CHEBI:35368)
Synonym  Source
β-D-glucopyranosyl-(1→4)-β-D-glucopyranosyl-(1→4)-β-D-glucopyranosyl-(1→4)-β-D-glucopyranosyl-(1→4)-β-D-glucopyranosyl-(1→4)-D-glucono-1,5-lactoneSUBMITTER
UniProt Name  Source
D-cellohexaono-1,5-lactoneUniProt