CHEBI:102594 - N-[(4R,7R,8S)-5-(cyclopropylmethyl)-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-4-oxanecarboxamide

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name N-[(4R,7R,8S)-5-(cyclopropylmethyl)-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-4-oxanecarboxamide
ChEBI ID CHEBI:102594
Stars This entity has been manually annotated by a third party.
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Formula C27H41N3O5
Net Charge 0
Average Mass 487.633
Monoisotopic Mass 487.30462
InChI InChI=1S/C27H41N3O5/c1-18-14-30(15-20-5-6-20)19(2)17-35-24-8-7-22(28-26(31)21-9-11-34-12-10-21)13-23(24)27(32)29(3)16-25(18)33-4/h7-8,13,18-21,25H,5-6,9-12,14-17H2,1-4H3,(H,28,31)/t18-,19-,25-/m1/s1
InChIKey WQZORWGHLUMPIH-MPCDZSKCSA-N
SMILES C[C@@H]1CN([C@@H](COC2=C(C=C(C=C2)NC(=O)C3CCOCC3)C(=O)N(C[C@H]1OC)C)C)CC4CC4
ChEBI Ontology
Outgoing N-[(4R,7R,8S)-5-(cyclopropylmethyl)-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-4-oxanecarboxamide (CHEBI:102594) is a azamacrocycle (CHEBI:52898)
N-[(4R,7R,8S)-5-(cyclopropylmethyl)-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-4-oxanecarboxamide (CHEBI:102594) is a lactam (CHEBI:24995)
Manual Xref Database
LSM-13941 LINCS
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