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Details

Stereochemistry ABSOLUTE
Molecular Formula C28H34N2O3
Molecular Weight 446.5812
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-((2S,3S,5S)-5-AMINO-3-HYDROXY-1,6-DIPHENYLHEXAN-2-YL)-2-(2,6-DIMETHYLPHENOXY)ACETAMIDE

SMILES

CC1=CC=CC(C)=C1OCC(=O)N[C@@H](CC2=CC=CC=C2)[C@@H](O)C[C@@H](N)CC3=CC=CC=C3

InChI

InChIKey=LWXUXIDLCWPHIW-GSDHBNRESA-N
InChI=1S/C28H34N2O3/c1-20-10-9-11-21(2)28(20)33-19-27(32)30-25(17-23-14-7-4-8-15-23)26(31)18-24(29)16-22-12-5-3-6-13-22/h3-15,24-26,31H,16-19,29H2,1-2H3,(H,30,32)/t24-,25-,26-/m0/s1

HIDE SMILES / InChI

Molecular Formula C28H34N2O3
Molecular Weight 446.5812
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
S21JGQ154U
Record Status Validated (UNII)
Record Version