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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H36NO18P
Molecular Weight 609.4695
Optical Activity UNSPECIFIED
Defined Stereocenters 15 / 15
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of O-2-(Acetylamino)-2-deoxy-?-D-mannopyranosyl-(1?4)-O-?-D-glucopyranosyl-(1?2)-6-deoxy-?-L-mannopyranose 1-(dihydrogen phosphate)

SMILES

C[C@@H]1O[C@@H](OP(O)(O)=O)[C@H](O[C@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3NC(C)=O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O

InChI

InChIKey=YNNJZYUDMLAEGP-UNHNRVGISA-N
InChI=1S/C20H36NO18P/c1-5-10(25)13(28)17(20(34-5)39-40(31,32)33)38-19-15(30)14(29)16(8(4-23)36-19)37-18-9(21-6(2)24)12(27)11(26)7(3-22)35-18/h5,7-20,22-23,25-30H,3-4H2,1-2H3,(H,21,24)(H2,31,32,33)/t5-,7+,8+,9-,10-,11+,12+,13+,14+,15+,16+,17+,18-,19+,20-/m0/s1

HIDE SMILES / InChI

Molecular Formula C20H36NO18P
Molecular Weight 609.4695
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 15 / 15
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 17:54:51 GMT 2025
Edited
by admin
on Wed Apr 02 17:54:51 GMT 2025
Record UNII
CBE2SGY2U5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
O-2-(Acetylamino)-2-deoxy-?-D-mannopyranosyl-(1?4)-O-?-D-glucopyranosyl-(1?2)-6-deoxy-?-L-mannopyranose 1-(dihydrogen phosphate)
Common Name English
Streptococcus pneumoniae serotypes 19F trisaccharide repeat unit with a phosphoester linker
Preferred Name English
?-L-Mannopyranose, O-2-(acetylamino)-2-deoxy-?-D-mannopyranosyl-(1?4)-O-?-D-glucopyranosyl-(1?2)-6-deoxy-, 1-(dihydrogen phosphate)
Common Name English
Code System Code Type Description
CAS
74550-84-8
Created by admin on Wed Apr 02 17:54:51 GMT 2025 , Edited by admin on Wed Apr 02 17:54:51 GMT 2025
PRIMARY
FDA UNII
CBE2SGY2U5
Created by admin on Wed Apr 02 17:54:51 GMT 2025 , Edited by admin on Wed Apr 02 17:54:51 GMT 2025
PRIMARY
PUBCHEM
11028706
Created by admin on Wed Apr 02 17:54:51 GMT 2025 , Edited by admin on Wed Apr 02 17:54:51 GMT 2025
PRIMARY
Related Record Type Details
PARENT ORGANISM -> PART/FRACTION