Terminology Service for NFDI4Health

D-cellohexaono-1,5-lactone

Go to external page http://purl.obolibrary.org/obo/CHEBI_143174


Term info

Label

D-cellohexaono-1,5-lactone

Synonyms
  • D-cellohexaono-1,5-lactone
Subsets

2_STAR

charge

0

formula

C36H60O31

has obo namespace

chebi_ontology

has related synonym

beta-D-glucopyranosyl-(1->4)-beta-D-glucopyranosyl-(1->4)-beta-D-glucopyranosyl-(1->4)-beta-D-glucopyranosyl-(1->4)-beta-D-glucopyranosyl-(1->4)-D-glucono-1,5-lactone

id

CHEBI:143174

inchi

InChI=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

inchikey

QYBQUOGVPYOWBW-WLFNWXPVSA-N

mass

988.845

monoisotopicmass

988.31186

smiles

[C@H]1([C@H](O[C@@H](O[C@@H]2[C@H](OC(=O)[C@@H]([C@H]2O)O)CO)[C@@H]([C@H]1O)O)CO)O[C@@H]3O[C@@H]([C@@H](O[C@@H]4O[C@@H]([C@@H](O[C@@H]5O[C@@H]([C@@H](O[C@@H]6O[C@@H]([C@@H](O)[C@@H]([C@H]6O)O)CO)[C@@H]([C@H]5O)O)CO)[C@@H]([C@H]4O)O)CO)[C@@H]([C@H]3O)O)CO