CHEBI:117437 - 2-[(1R,3S,4aS,9aR)-6-(benzenesulfonamido)-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-(cyclopropylmethyl)acetamide

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ChEBI Name 2-[(1R,3S,4aS,9aR)-6-(benzenesulfonamido)-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-(cyclopropylmethyl)acetamide
ChEBI ID CHEBI:117437
Stars This entity has been manually annotated by a third party.
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Formula C24H28N2O6S
Net Charge 0
Average Mass 472.556
Monoisotopic Mass 472.16681
InChI InChI=1S/C24H28N2O6S/c27-14-22-24-20(11-17(31-22)12-23(28)25-13-15-6-7-15)19-10-16(8-9-21(19)32-24)26-33(29,30)18-4-2-1-3-5-18/h1-5,8-10,15,17,20,22,24,26-27H,6-7,11-14H2,(H,25,28)/t17-,20-,22+,24+/m0/s1
InChIKey UITZQDWRSZBATF-HYWXBTQMSA-N
SMILES C1CC1CNC(=O)C[C@@H]2C[C@@H]3[C@H]([C@H](O2)CO)OC4=C3C=C(C=C4)NS(=O)(=O)C5=CC=CC=C5
ChEBI Ontology
Outgoing 2-[(1R,3S,4aS,9aR)-6-(benzenesulfonamido)-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-(cyclopropylmethyl)acetamide (CHEBI:117437) is a sulfonamide (CHEBI:35358)
Manual Xref Database
LSM-28886 LINCS
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