
 UPCMLD04ASTW002110

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M  END

>  <Chemical Name>
UPCMLD04ASTW002110

>  <PubChem CID>
3247284

>  <Formula>
C26H32N2O3

>  <Molecular Weight>
420.553000

>  <IUPAC Name>
benzyl N-[(S)-[(1S,2R)-2-[(2R)-1-(cyclopropylmethylamino)-1-oxopropan-2-yl]-1-methylcyclopropyl]-phenylmethyl]carbamate

>  <XlogP>
4.6

>  <Hydrogen Bond Donors>
2

>  <Hydrogen Bond Acceptors>
3

>  <Canonical SMILES>
CC(C1CC1(C)C(C2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3)C(=O)NCC4CC4

>  <Isomeric SMILES>
C[C@H]([C@H]1C[C@]1(C)[C@@H](C2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3)C(=O)NCC4CC4

>  <InChI Std. ID>
InChI=1S/C26H32N2O3/c1-18(24(29)27-16-19-13-14-19)22-15-26(22,2)23(21-11-7-4-8-12-21)28-25(30)31-17-20-9-5-3-6-10-20/h3-12,18-19,22-23H,13-17H2,1-2H3,(H,27,29)(H,28,30)/t18-,22-,23-,26+/m1/s1

>  <InChI Key>
AABYLPRACHMDSN-DDKMDXNESA-N

