IM1

(2R,4S,5S,1'S)-2-PHENYLMETHYL-4-HYDROXY-5-(TERT-BUTOXYCARBONYL)AMINO-6-PHENYL HEXANOYL-N-(1'-IMIDAZO-2-YL)-2'-METHYLPROPANAMIDE


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Chemical Component Summary

Name(2R,4S,5S,1'S)-2-PHENYLMETHYL-4-HYDROXY-5-(TERT-BUTOXYCARBONYL)AMINO-6-PHENYL HEXANOYL-N-(1'-IMIDAZO-2-YL)-2'-METHYLPROPANAMIDE
Identifierstert-butyl N-[(2S,3S,5R)-3-hydroxy-6-[[(1S)-1-(1H-imidazol-2-yl)-2-methyl-propyl]amino]-6-oxo-1-phenyl-5-(phenylmethyl)hexan-2-yl]carbamate
FormulaC31 H42 N4 O4
Molecular Weight534.69
TypeNON-POLYMER
Isomeric SMILESCC(C)[C@@H](c1[nH]ccn1)NC(=O)[C@H](Cc2ccccc2)C[C@@H]([C@H](Cc3ccccc3)NC(=O)OC(C)(C)C)O
InChIInChI=1S/C31H42N4O4/c1-21(2)27(28-32-16-17-33-28)35-29(37)24(18-22-12-8-6-9-13-22)20-26(36)25(19-23-14-10-7-11-15-23)34-30(38)39-31(3,4)5/h6-17,21,24-27,36H,18-20H2,1-5H3,(H,32,33)(H,34,38)(H,35,37)/t24-,25+,26+,27+/m1/s1
InChIKeyQAHXABIFJPGWDD-WKAQUBQDSA-N

Chemical Details

Formal Charge0
Atom Count81
Chiral Atom Count4
Bond Count83
Aromatic Bond Count17

Related Resource References

Resource NameReference
PubChem 5496674