CHEBI:103712 - (2R,3S)-8-[3-(dimethylamino)prop-1-ynyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-6-one

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (2R,3S)-8-[3-(dimethylamino)prop-1-ynyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-6-one
ChEBI ID CHEBI:103712
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C20H30N4O3
Net Charge 0
Average Mass 374.478
Monoisotopic Mass 374.23179
InChI InChI=1S/C20H30N4O3/c1-14-12-24(15(2)13-25)20(26)17-9-16(7-6-8-23(4)5)10-22-19(17)27-18(14)11-21-3/h9-10,14-15,18,21,25H,8,11-13H2,1-5H3/t14-,15+,18-/m0/s1
InChIKey QMNNXCXXHUAUDR-DAYGRLMNSA-N
SMILES C[C@H]1CN(C(=O)C2=C(N=CC(=C2)C#CCN(C)C)O[C@H]1CNC)[C@H](C)CO
ChEBI Ontology
Outgoing (2R,3S)-8-[3-(dimethylamino)prop-1-ynyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-6-one (CHEBI:103712) is a aromatic ether (CHEBI:35618)
Manual Xref Database
LSM-15056 LINCS
View more database links