CHEBI:100074 - N-[(2S,3R,6S)-6-[2-(4-cyclohexyl-1-triazolyl)ethyl]-2-(hydroxymethyl)-3-oxanyl]-2-(4-morpholinyl)acetamide

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name N-[(2S,3R,6S)-6-[2-(4-cyclohexyl-1-triazolyl)ethyl]-2-(hydroxymethyl)-3-oxanyl]-2-(4-morpholinyl)acetamide
ChEBI ID CHEBI:100074
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C22H37N5O4
Net Charge 0
Average Mass 435.561
Monoisotopic Mass 435.28455
InChI InChI=1S/C22H37N5O4/c28-16-21-19(23-22(29)15-26-10-12-30-13-11-26)7-6-18(31-21)8-9-27-14-20(24-25-27)17-4-2-1-3-5-17/h14,17-19,21,28H,1-13,15-16H2,(H,23,29)/t18-,19+,21+/m0/s1
InChIKey ASLPZONUTGKWLH-QKNQBKEWSA-N
SMILES C1CCC(CC1)C2=CN(N=N2)CC[C@@H]3CC[C@H]([C@H](O3)CO)NC(=O)CN4CCOCC4
ChEBI Ontology
Outgoing N-[(2S,3R,6S)-6-[2-(4-cyclohexyl-1-triazolyl)ethyl]-2-(hydroxymethyl)-3-oxanyl]-2-(4-morpholinyl)acetamide (CHEBI:100074) is a amino acid amide (CHEBI:22475)
Manual Xref Database
LSM-11453 LINCS
View more database links