CHEBI:140518 - Ac-(D)Phe-Pro-boroArg-OH(1+)

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ChEBI Name Ac-(D)Phe-Pro-boroArg-OH(1+)
ChEBI ID CHEBI:140518
ChEBI ASCII Name Ac-(D)Phe-Pro-boroArg-OH(1+)
Definition A guanidinium ion resulting from the protonation of the guanidino group of Ac-(D)Phe-Pro-boroArg-OH. The major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C21H34BN6O5
Net Charge +1
Average Mass 461.344
Monoisotopic Mass 461.26783
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)/p+1/t16-,17+,18+/m1/s1
InChIKey FXFYPTZERULUBS-SQNIBIBYSA-O
SMILES N([C@@H](CCCNC(N)=[NH2+])B(O)O)C(=O)[C@@H]1CCCN1C([C@@H](CC2=CC=CC=C2)NC(C)=O)=O
ChEBI Ontology
Outgoing Ac-(D)Phe-Pro-boroArg-OH(1+) (CHEBI:140518) is a guanidinium ion (CHEBI:60251)
Ac-(D)Phe-Pro-boroArg-OH(1+) (CHEBI:140518) is conjugate acid of Ac-(D)Phe-Pro-boroArg-OH (CHEBI:42142)
Incoming DuP-714 (CHEBI:140472) has part Ac-(D)Phe-Pro-boroArg-OH(1+) (CHEBI:140518)
Ac-(D)Phe-Pro-boroArg-OH (CHEBI:42142) is conjugate base of Ac-(D)Phe-Pro-boroArg-OH(1+) (CHEBI:140518)
Last Modified
04 April 2018