CHEBI:97114 - N-[(2S,3S,6S)-2-(hydroxymethyl)-6-[2-[4-(4-methoxyphenyl)-1-triazolyl]ethyl]-3-oxanyl]-3-(1-piperidinyl)propanamide

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name N-[(2S,3S,6S)-2-(hydroxymethyl)-6-[2-[4-(4-methoxyphenyl)-1-triazolyl]ethyl]-3-oxanyl]-3-(1-piperidinyl)propanamide ChEBI ID CHEBI:97114 Stars This entity has been manually annotated by a third party. Supplier Information ChemicalBook:CB3853625, eMolecules:478578, ZINC000001532732 Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C25H37N5O4 Net Charge 0 Average Mass 471.593 Monoisotopic Mass 471.28455 InChI InChI=1S/C25H37N5O4/c1-33-20-7-5-19(6-8-20)23-17-30(28-27-23)16-11-21-9-10-22(24(18-31)34-21)26-25(32)12-15-29-13-3-2-4-14-29/h5-8,17,21-22,24,31H,2-4,9-16,18H2,1H3,(H,26,32)/t21-,22-,24+/m0/s1 InChIKey CTEVGNUGMCZMIF-WPFOTENUSA-N SMILES COC1=CC=C(C=C1)C2=CN(N=N2)CC[C@@H]3CC[C@@H]([C@H](O3)CO)NC(=O)CCN4CCCCC4 ChEBI Ontology Outgoing N-[(2S,3S,6S)-2-(hydroxymethyl)-6-[2-[4-(4-methoxyphenyl)-1-triazolyl]ethyl]-3-oxanyl]-3-(1-piperidinyl)propanamide (CHEBI:97114) is a C-glycosyl compound (CHEBI:20857) Manual Xref Database LSM-8493 LINCS View more database links