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CHEBI:49944 - N-[(1S,2R)-1-benzyl-3-(cyclohexylamino)-2-hydroxypropyl]-3-(ethylamino)-5-(2-oxopyrrolidin-1-yl)benzamide

Default Structure
ChEBI IDCHEBI:49944
ChEBI NameN-[(1S,2R)-1-benzyl-3-(cyclohexylamino)-2-hydroxypropyl]-3-(ethylamino)-5-(2-oxopyrrolidin-1-yl)benzamide
Stars
Last Modified17 October 2009
DownloadsMolfile
FormulaC29H40N4O3
Net Charge0
Average Mass492.664
Monoisotopic Mass492.31004
SMILES[H]O[C@]([H])(C([H])([H])N([H])C1([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C1([H])[H])[C@@]([H])(N([H])C(=O)c1c([H])c(N([H])C([H])([H])C([H])([H])[H])c([H])c(N2C(=O)C([H])([H])C([H])([H])C2([H])[H])c1[H])C([H])([H])c1c([H])c([H])c([H])c([H])c1[H]
InChIInChI=1S/C29H40N4O3/c1-2-30-24-17-22(18-25(19-24)33-15-9-14-28(33)35)29(36)32-26(16-21-10-5-3-6-11-21)27(34)20-31-23-12-7-4-8-13-23/h3,5-6,10-11,17-19,23,26-27,30-31,34H,2,4,7-9,12-16,20H2,1H3,(H,32,36)/t26-,27+/m0/s1
InChIKeyPVDHVIVUNLQJLY-RRPNLBNLSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[(1S,2R)-1-benzyl-3-(cyclohexylamino)-2-hydroxypropyl]-3-(ethylamino)-5-(2-oxopyrrolidin-1-yl)benzamide (CHEBI:49944) is a unclassifieds (CHEBI:27189)
Synonym  Source
N-[(1S,2R)-1-benzyl-3-(cyclohexylamino)-2-hydroxypropyl]-3-(ethylamino)-5-(2-oxopyrrolidin-1-yl)benzamidePDBeChem
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