Catalog Number:
AG004N4D
Chemical Name:
L-Arginine, L-tyrosyl-L-asparaginyl-L-asparaginyl-L-tryptophyl-L-prolyl-
CAS Number:
848350-42-5
Molecular Formula:
C39H52N12O10
Molecular Weight:
848.9046
IUPAC Name:
(2S)-2-[[(2S)-1-[(2S)-2-[[(2S)-4-amino-2-[[(2S)-4-amino-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-4-oxobutanoyl]amino]-4-oxobutanoyl]amino]-3-(1H-indol-3-yl)propanoyl]pyrrolidine-2-carbonyl]amino]-5-(diaminomethylideneamino)pentanoic acid
InChI:
InChI=1S/C39H52N12O10/c40-24(15-20-9-11-22(52)12-10-20)33(55)48-27(17-31(41)53)34(56)49-28(18-32(42)54)35(57)50-29(16-21-19-46-25-6-2-1-5-23(21)25)37(59)51-14-4-8-30(51)36(58)47-26(38(60)61)7-3-13-45-39(43)44/h1-2,5-6,9-12,19,24,26-30,46,52H,3-4,7-8,13-18,40H2,(H2,41,53)(H2,42,54)(H,47,58)(H,48,55)(H,49,56)(H,50,57)(H,60,61)(H4,43,44,45)/t24-,26-,27-,28-,29-,30-/m0/s1
InChI Key:
VZAXNNBVEIWKJG-POPCVQDUSA-N
SMILES:
NC(=O)C[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)CCCNC(=N)N)Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(cc1)O)N)CC(=O)N