O-2-(Acetylamino)-2-deoxy-β-D-mannopyranosyl-(1→4)-O-α-D-glucopyranosyl-(1→3)-6-deoxy-α-L-mannopyranose 1-(dihydrogen phosphate)

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-β-D-mannopyranosyl-(1→4)-O-α-D-glucopyranosyl-(1→3)-6-deoxy-α-L-mannopyranose 1-(dihydrogen phosphate)

Structure Search

SMILES

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

InChI

InChIKey=WNTYPINRDVAMRH-UNHNRVGISA-N

InChI=1S/C20H36NO18P/c1-5-10(25)17(15(30)20(34-5)39-40(31,32)33)38-19-14(29)13(28)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 `Sat Dec 16 20:17:42 UTC 2023` Edited by `admin` on `Sat Dec 16 20:17:42 UTC 2023`
Record UNII	TP4SVT6VTW
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

O-2-(Acetylamino)-2-deoxy-β-D-mannopyranosyl-(1→4)-O-α-D-glucopyranosyl-(1→3)-6-deoxy-α-L-mannopyranose 1-(dihydrogen phosphate)

Common Name

English

Streptococcus pneumoniae serotypes 19A trisaccharide repeat unit with a phosphoester linker

Common Name

English

α-L-Mannopyranose, O-2-(acetylamino)-2-deoxy-β-D-mannopyranosyl-(1→4)-O-α-D-glucopyranosyl-(1→3)-6-deoxy-, 1-(dihydrogen phosphate)

Common Name

English

Code System Code Type Description

FDA UNII

TP4SVT6VTW

Created by admin on Sat Dec 16 20:17:42 UTC 2023 , Edited by admin on Sat Dec 16 20:17:42 UTC 2023

PRIMARY

CAS

798561-02-1

Created by admin on Sat Dec 16 20:17:42 UTC 2023 , Edited by admin on Sat Dec 16 20:17:42 UTC 2023

PRIMARY

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