N-[(S)-[(1S,2R)-1-methyl-2-[(2R)-1-oxo-1-[(phenylmethyl)amino]propan-2-yl]cyclopropyl]-phenylmethyl]carbamic acid (phenylmethyl) ester (Q27199138)

UPCMLD04ASTW002108 (English)

11 October 2016

chemical formula

C₂₉H₃₂N₂O₃

1 reference

UPCMLD04ASTW002108 (English)

11 October 2016

canonical SMILES

CC(C1CC1(C)C(C2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3)C(=O)NCC4=CC=CC=C4

1 reference

UPCMLD04ASTW002108 (English)

11 October 2016

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)NCC4=CC=CC=C4

1 reference

UPCMLD04ASTW002108 (English)

InChI=1S/C29H32N2O3/c1-21(27(32)30-19-22-12-6-3-7-13-22)25-18-29(25,2)26(24-16-10-5-11-17-24)31-28(33)34-20-23-14-8-4-9-15-23/h3-17,21,25-26H,18-20H2,1-2H3,(H,30,32)(H,31,33)/t21-,25-,26-,29+/m1/s1

11 October 2016

Identifiers

InChI

1 reference

UPCMLD04ASTW002108 (English)

WQTGKLHQESDVBY-UXJUWBFNSA-N

11 October 2016

InChIKey

2 references

UPCMLD04ASTW002108 (English)

11 October 2016

stated in

ChEBI release 2020-09-01

1 reference

Benzyl [(S)-{(1S,2R)-2-[(2R)-1-(benzylamino)-1-oxo-2-propanyl]-1-methylcyclopropyl}(phenyl)methyl]carbamate (English)

11 October 2016

1 reference

UPCMLD04ASTW002108 (English)

11 October 2016

ChEBI ID

116280

mapping relation type

1 reference

N-[(S)-[(1S,2R)-1-methyl-2-[(2R)-1-oxo-1-[(phenylmethyl)amino]propan-2-yl]cyclopropyl]-phenylmethyl]carbamic acid (phenylmethyl) ester (English)

11 October 2016

1 reference