N-[3-[2-[2-(2-Azidoethoxy)ethoxy]ethoxy]-1-oxopropyl]-L-valyl-N5-(aminocarbonyl)-N-[4-[[[(4-nitrophenoxy)carbonyl]oxy]methyl]phenyl]-L-ornithinamide

CAS Registry Number®

2055047-18-0

CAS Name

N-[3-[2-[2-(2-Azidoethoxy)ethoxy]ethoxy]-1-oxopropyl]-L-valyl-N5-(aminocarbonyl)-N-[4-[[[(4-nitrophenoxy)carbonyl]oxy]methyl]phenyl]-L-ornithinamide

Molecular Formula

C34H47N9O12

Cite this Page

N-[3-[2-[2-(2-Azidoethoxy)ethoxy]ethoxy]-1-oxopropyl]-L-valyl-N5-(aminocarbonyl)-N-[4-[[[(4-nitrophenoxy)carbonyl]oxy]methyl]phenyl]-L-ornithinamide.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=2055047-18-0 (retrieved 2024-11-24) (CAS RN: 2055047-18-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C34H47N9O12/c1-23(2)30(41-29(44)13-16-51-18-20-53-21-19-52-17-15-38-42-36)32(46)40-28(4-3-14-37-33(35)47)31(45)39-25-7-5-24(6-8-25)22-54-34(48)55-27-11-9-26(10-12-27)43(49)50/h5-12,23,28,30H,3-4,13-22H2,1-2H3,(H,39,45)(H,40,46)(H,41,44)(H3,35,37,47)/t28-,30-/m0/s1

InChIKey

InChIKey=HLBCDJANEWKOSX-JDXGNMNLSA-N

SMILES

[C@H](C(NC1=CC=C(COC(OC2=CC=C(N(=O)=O)C=C2)=O)C=C1)=O)(NC([C@@H](NC(CCOCCOCCOCCN=[N+]=[N-])=O)[C@H](C)C)=O)CCCNC(N)=O

Canonical SMILES

[N-]=[N+]=NCCOCCOCCOCCC(=O)NC(C(=O)NC(C(=O)NC1=CC=C(C=C1)COC(=O)OC2=CC=C(C=C2)N(=O)=O)CCCNC(=O)N)C(C)C

Other Names for this Substance

  • L-Ornithinamide, N-[3-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]-1-oxopropyl]-L-valyl-N5-(aminocarbonyl)-N-[4-[[[(4-nitrophenoxy)carbonyl]oxy]methyl]phenyl]-
  • N-[3-[2-[2-(2-Azidoethoxy)ethoxy]ethoxy]-1-oxopropyl]-L-valyl-N5-(aminocarbonyl)-N-[4-[[[(4-nitrophenoxy)carbonyl]oxy]methyl]phenyl]-L-ornithinamide
  • Azide-PEG3-Val-Ch-PAB-PNP

CAS INSIGHTSTM
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