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CHEBI:44977 - BETA-PHENYL-N-{[(PHENYLMETHYL)OXY]CARBONYL}-D-PHENYLALANYL-N- [(1S,3E)-1-[DIHYDROXY(METHYLOXY)(PHENYLOXY)-LAMBDA5-PHOSPHANYL]-4- (METHYLOXY)BUT-3-ENYL]-D-PROLINAMIDE

Default Structure
ChEBI IDCHEBI:44977
ChEBI NameBETA-PHENYL-N-{[(PHENYLMETHYL)OXY]CARBONYL}-D-PHENYLALANYL-N- [(1S,3E)-1-[DIHYDROXY(METHYLOXY)(PHENYLOXY)-LAMBDA5-PHOSPHANYL]-4- (METHYLOXY)BUT-3-ENYL]-D-PROLINAMIDE
Stars
DownloadsMolfile
FormulaC40H46N3O9P
Net Charge0
Average Mass743.794
Monoisotopic Mass743.29717
SMILES[H]O[P@TB2](O[H])(Oc1c([H])c([H])c([H])c([H])c1[H])(OC([H])([H])[H])[C@]([H])(N([H])C(=O)[C@@]1([H])N(C(=O)[C@]([H])(N([H])C(=O)OC([H])([H])c2c([H])c([H])c([H])c([H])c2[H])C([H])(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])C([H])([H])C1([H])[H])C([H])([H])/C([H])=C(\[H])OC([H])([H])[H]
InChIInChI=1S/C40H46N3O9P/c1-49-28-16-26-35(53(47,48,50-2)52-33-23-13-6-14-24-33)41-38(44)34-25-15-27-43(34)39(45)37(42-40(46)51-29-30-17-7-3-8-18-30)36(31-19-9-4-10-20-31)32-21-11-5-12-22-32/h3-14,16-24,28,34-37,47-48H,15,25-27,29H2,1-2H3,(H,41,44)(H,42,46)/b28-16+/t34-,35-,37+/m0/s1
InChIKeyQSFRPIRTVOLCSO-QPQVSWKTSA-N
ChEBI Ontology
Outgoing Relation(s)
BETA-PHENYL-N-{[(PHENYLMETHYL)OXY]CARBONYL}-D-PHENYLALANYL-N- [(1S,3E)-1-[DIHYDROXY(METHYLOXY)(PHENYLOXY)-LAMBDA5-PHOSPHANYL]-4- (METHYLOXY)BUT-3-ENYL]-D-PROLINAMIDE (CHEBI:44977) is a unclassifieds (CHEBI:27189)
Synonyms  Source
BETA-PHENYL-N-{[(PHENYLMETHYL)OXY]CARBONYL}-D-PHENYLALANYL-N- [(1S,3E)-1-[DIHYDROXY(METHYLOXY)(PHENYLOXY)-LAMBDA5-PHOSPHANYL]-4- (METHYLOXY)BUT-3-ENYL]-D-PROLINAMIDEPDBeChem
N-[(benzyloxy)carbonyl]-beta-phenyl-D-phenylalanyl-N-{(1S,3E)-1-[dihydroxy(methoxy)phenoxy-lambda~5~-phosphanyl]-4-methoxybut-3-en-1-yl}-L-prolinamidePDBeChem
Manual XrefsDatabases
PHWPDBeChem