CHEBI:95831 - (8R,9R)-6-[(2R)-1-hydroxypropan-2-yl]-9-[[(3-methoxyphenyl)methyl-methylamino]methyl]-8-methyl-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-5-one

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (8R,9R)-6-[(2R)-1-hydroxypropan-2-yl]-9-[[(3-methoxyphenyl)methyl-methylamino]methyl]-8-methyl-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-5-one
ChEBI ID CHEBI:95831
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C24H37N5O4
Net Charge 0
Average Mass 459.583
Monoisotopic Mass 459.28455
InChI InChI=1S/C24H37N5O4/c1-18-13-28(19(2)16-30)24(31)9-6-10-29-21(12-25-26-29)17-33-23(18)15-27(3)14-20-7-5-8-22(11-20)32-4/h5,7-8,11-12,18-19,23,30H,6,9-10,13-17H2,1-4H3/t18-,19-,23+/m1/s1
InChIKey GEARZFJDEYGDIT-PWHSHALESA-N
SMILES C[C@@H]1CN(C(=O)CCCN2C(=CN=N2)CO[C@H]1CN(C)CC3=CC(=CC=C3)OC)[C@H](C)CO
ChEBI Ontology
Outgoing (8R,9R)-6-[(2R)-1-hydroxypropan-2-yl]-9-[[(3-methoxyphenyl)methyl-methylamino]methyl]-8-methyl-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-5-one (CHEBI:95831) is a azamacrocycle (CHEBI:52898)
(8R,9R)-6-[(2R)-1-hydroxypropan-2-yl]-9-[[(3-methoxyphenyl)methyl-methylamino]methyl]-8-methyl-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-5-one (CHEBI:95831) is a lactam (CHEBI:24995)
Manual Xref Database
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