CHEBI:98867 - 2-[(2S,3S,6R)-2-(hydroxymethyl)-3-[(4-methylphenyl)sulfonylamino]-3,6-dihydro-2H-pyran-6-yl]-N-[2-(1-piperidinyl)ethyl]acetamide

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ChEBI Name 2-[(2S,3S,6R)-2-(hydroxymethyl)-3-[(4-methylphenyl)sulfonylamino]-3,6-dihydro-2H-pyran-6-yl]-N-[2-(1-piperidinyl)ethyl]acetamide
ChEBI ID CHEBI:98867
Stars This entity has been manually annotated by a third party.
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Formula C22H33N3O5S
Net Charge 0
Average Mass 451.581
Monoisotopic Mass 451.21409
InChI InChI=1S/C22H33N3O5S/c1-17-5-8-19(9-6-17)31(28,29)24-20-10-7-18(30-21(20)16-26)15-22(27)23-11-14-25-12-3-2-4-13-25/h5-10,18,20-21,24,26H,2-4,11-16H2,1H3,(H,23,27)/t18-,20-,21+/m0/s1
InChIKey VUOOERVJSWLFKU-SESVDKBCSA-N
SMILES CC1=CC=C(C=C1)S(=O)(=O)N[C@H]2C=C[C@H](O[C@@H]2CO)CC(=O)NCCN3CCCCC3
ChEBI Ontology
Outgoing 2-[(2S,3S,6R)-2-(hydroxymethyl)-3-[(4-methylphenyl)sulfonylamino]-3,6-dihydro-2H-pyran-6-yl]-N-[2-(1-piperidinyl)ethyl]acetamide (CHEBI:98867) is a sulfonamide (CHEBI:35358)
Manual Xref Database
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