Terminology Service for NFDI4Health
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N-[(2R,3R)-2-[[[(cyclohexylamino)-oxomethyl]-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3-(4-morpholinyl)propanamide

Go to external page http://purl.obolibrary.org/obo/CHEBI_108754

Term info

Label

N-[(2R,3R)-2-[[[(cyclohexylamino)-oxomethyl]-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3-(4-morpholinyl)propanamide

database cross reference
Subsets

2_STAR

charge

0

formula

C31H49N5O6

has obo namespace

chebi_ontology

id

CHEBI:108754

inchi

InChI=1S/C31H49N5O6/c1-22-19-36(23(2)21-37)30(39)18-24-17-26(32-29(38)11-12-35-13-15-41-16-14-35)9-10-27(24)42-28(22)20-34(3)31(40)33-25-7-5-4-6-8-25/h9-10,17,22-23,25,28,37H,4-8,11-16,18-21H2,1-3H3,(H,32,38)(H,33,40)/t22-,23+,28+/m1/s1

inchikey

VGGDTLLTAGJVNH-IWHLBADBSA-N

mass

587.752

monoisotopicmass

587.36828

smiles

C[C@@H]1CN(C(=O)CC2=C(C=CC(=C2)NC(=O)CCN3CCOCC3)O[C@H]1CN(C)C(=O)NC4CCCCC4)[C@@H](C)CO