1SD

(1S)-1,5-anhydro-1-sulfamoyl-D-galactitol

Created:	2009-06-02
Last modified:	2020-07-17

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1 entries where 1SD is found as a standalone ligand1 entries where 1SD is found in a branched oligosaccharide

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Chemical Details
Formal Charge	0
Atom Count	28
Chiral Atom Count	5
Bond Count	28
Aromatic Bond Count	0

2D diagram of 1SD

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Chemical Component Summary
Name	(1S)-1,5-anhydro-1-sulfamoyl-D-galactitol
Synonyms	(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxane-2-sulfonamide; (1S)-D-Galactopyranosylsulfonamide
Systematic Name (OpenEye OEToolkits)	(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxane-2-sulfonamide
Formula	C₆ H₁₃ N O₇ S
Molecular Weight	243.235
Type	D-SACCHARIDE

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	O=S(=O)(N)C1OC(C(O)C(O)C1O)CO
SMILES	CACTVS	3.341	N[S](=O)(=O)[CH]1O[CH](CO)[CH](O)[CH](O)[CH]1O
SMILES	OpenEye OEToolkits	1.5.0	C(C1C(C(C(C(O1)S(=O)(=O)N)O)O)O)O
Canonical SMILES	CACTVS	3.341	N[S](=O)(=O)[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O
Canonical SMILES	OpenEye OEToolkits	1.5.0	C([C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)S(=O)(=O)N)O)O)O)O
InChI	InChI	1.03	InChI=1S/C6H13NO7S/c7-15(12,13)6-5(11)4(10)3(9)2(1-8)14-6/h2-6,8-11H,1H2,(H2,7,12,13)/t2-,3+,4+,5-,6+/m1/s1
InChIKey	InChI	1.03	OQMMAWGZUDHRTA-PHYPRBDBSA-N

Related Resource References

Resource Name	Reference
PubChem	42597613
ChEMBL	CHEMBL569412

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