N-Acetyl-D-phenylalanyl-N-[(1R)-4-[(aminoiminomethyl)amino]-1-boronobutyl]-L-prolinamide

CAS Registry Number®

130982-43-3

CAS Name

N-Acetyl-D-phenylalanyl-N-[(1R)-4-[(aminoiminomethyl)amino]-1-boronobutyl]-L-prolinamide

Molecular Formula

C21H33BN6O5

Molecular Mass

460.33

Cite this Page

N-Acetyl-D-phenylalanyl-N-[(1R)-4-[(aminoiminomethyl)amino]-1-boronobutyl]-L-prolinamide.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=130982-43-3 (retrieved 2024-11-22) (CAS RN: 130982-43-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C21H33BN6O5/c1-14(29)26-16(13-15-7-3-2-4-8-15)20(31)28-12-6-9-17(28)19(30)27-18(22(32)33)10-5-11-25-21(23)24/h2-4,7-8,16-18,32-33H,5-6,9-13H2,1H3,(H,26,29)(H,27,30)(H4,23,24,25)/t16-,17+,18+/m1/s1

InChIKey

InChIKey=FXFYPTZERULUBS-SQNIBIBYSA-N

SMILES

C([C@@H](CC1=CC=CC=C1)NC(C)=O)(=O)N2[C@H](C(N[C@@H](CCCNC(=N)N)B(O)O)=O)CCC2

Canonical SMILES

O=C(NC(C(=O)N1CCCC1C(=O)NC(B(O)O)CCCNC(=N)N)CC=2C=CC=CC2)C

Other Names for this Substance

  • L-Prolinamide, N-acetyl-D-phenylalanyl-N-[(1R)-4-[(aminoiminomethyl)amino]-1-boronobutyl]-
  • L-Prolinamide, N-acetyl-D-phenylalanyl-N-[4-[(aminoiminomethyl)amino]-1-boronobutyl]-, (R)-
  • N-Acetyl-D-phenylalanyl-N-[(1R)-4-[(aminoiminomethyl)amino]-1-boronobutyl]-L-prolinamide
  • DuP 714

Deleted or Replaced CAS Registry Numbers

149820-98-4, 156302-23-7

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