PRD_900016

beta-cellopentaose

PRD_900016 is described in the Biologically Interesting Molecule Reference Dictionary (BIRD).

The representative PDB ID is 3PL3.

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Chemical Component Summary

Namebeta-cellopentaose
Identifiers(2~{R},3~{S},4~{S},5~{R},6~{S})-2-(hydroxymethyl)-6-[(2~{R},3~{S},4~{R},5~{R},6~{S})-2-(hydroxymethyl)-6-[(2~{R},3~{S}, 4~{R},5~{R},6~{S})-2-(hydroxymethyl)-6-[(2~{R},3~{S},4~{R},5~{R},6~{S})-2-(hydroxymethyl)-6-[(2~{R},3~{S},4~{R},5~{R},6~ {R})-2-(hydroxymethyl)-4,5,6-tris(oxidanyl)oxan-3-yl]oxy-4,5-bis(oxidanyl)oxan-3-yl]oxy-4,5-bis(oxidanyl)oxan-3-yl]oxy-4 ,5-bis(oxidanyl)oxan-3-yl]oxy-oxane-3,4,5-triol
FormulaC30 H52 O26
Molecular Weight828.718
TypeSACCHARIDE
Isomeric SMILESC([C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)O[C@@H]2[C@H](O[C@H]([C@@H]([C@H]2O)O)O[C@@H]3[C@H](O[C@H]([C@@H]([C@H]3O)O)O[C@@ H]4[C@H](O[C@H]([C@@H]([C@H]4O)O)O[C@@H]5[C@H](O[C@H]([C@@H]([C@H]5O)O)O)CO)CO)CO)CO)O)O)O)O
InChIInChI=1S/C30H52O26/c31-1-6-11(36)12(37)18(43)27(49-6)54-23-8(3-33)51-29(20(45)14(23)39)56-25-10(5-35)52-30(21(46)16(25) 41)55-24-9(4-34)50-28(19(44)15(24)40)53-22-7(2-32)48-26(47)17(42)13(22)38/h6-47H,1-5H2/t6-,7-,8-,9-,10-,11-,12+,13-,14-, 15-,16-,17-,18-,19-,20-,21-,22-,23-,24-,25-,26-,27+,28+,29+,30+/m1/s1
InChIKeyFTNIPWXXIGNQQF-FFFJRYSISA-N
CompositionPolymer Sequences: BGC-BGC-BGC-BGC-BGC
BIRD classMETABOLISM
Represented AsBRANCHED
Compound Detailsn/a
Descriptionn/a

Chemical Details

Formal Charge0
Atom Count108
Chiral Atom Count25
Bond Count112
Aromatic Bond Count0

Related Resource References

Resource NameReference
PubChem 440949
ChEBI CHEBI:49536