CHEBI:107615 - (2S,4S)-4-(1-benzothiophen-3-yl)-2-[[4-(hydroxymethyl)phenyl]methoxy]-N-(phenylmethyl)-3,4-dihydro-2H-pyran-6-carboxamide

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ChEBI Name (2S,4S)-4-(1-benzothiophen-3-yl)-2-[[4-(hydroxymethyl)phenyl]methoxy]-N-(phenylmethyl)-3,4-dihydro-2H-pyran-6-carboxamide
ChEBI ID CHEBI:107615
Stars This entity has been manually annotated by a third party.
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Formula C29H27NO4S
Net Charge 0
Average Mass 485.596
Monoisotopic Mass 485.16608
InChI InChI=1S/C29H27NO4S/c31-17-21-10-12-22(13-11-21)18-33-28-15-23(25-19-35-27-9-5-4-8-24(25)27)14-26(34-28)29(32)30-16-20-6-2-1-3-7-20/h1-14,19,23,28,31H,15-18H2,(H,30,32)/t23-,28+/m1/s1
InChIKey HCHDWAVTMDCPLB-LXFBAYGMSA-N
SMILES C1[C@@H](C=C(O[C@@H]1OCC2=CC=C(C=C2)CO)C(=O)NCC3=CC=CC=C3)C4=CSC5=CC=CC=C54
ChEBI Ontology
Outgoing (2S,4S)-4-(1-benzothiophen-3-yl)-2-[[4-(hydroxymethyl)phenyl]methoxy]-N-(phenylmethyl)-3,4-dihydro-2H-pyran-6-carboxamide (CHEBI:107615) is a 1-benzothiophenes (CHEBI:38836)
Manual Xref Database
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