(2S)-2-Amino-N-[(2R,8S,13S,19S,22S)-22-amino-8,13-dibenzyl-23-(4-hydroxyphenyl)-19-methyl-3,6,9,12,15,18,21-heptaoxo-4,7,10,11,14,17,20-heptaazatricosan-2-yl]-3-(4-hydroxyphenyl)propanamide (non-prefe rred name)

More details:

• Systematic name

  (2S)-2-amino-N-[(1S)-2-[[2-[[(1S)-2-[2-[(2S)-2-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]acetyl]amino]-3-phenyl-propanoyl]hydrazino]-1-benzyl-2-oxo-ethyl]amino]-2-oxo-ethyl]amino]-1-methyl-2-oxo-ethyl]-3-(4-hydroxyphenyl)propanamide

• SMILES

  C[C@H](C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)NNC(=O)[C@H](Cc2ccccc2)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](Cc3ccc(cc3)O)N)NC(=O)[C@H](Cc4ccc(cc4)O)N

• Std. InChi

  InChI=1S/C46H56N10O10/c1-27(51-43(63)35(47)21-31-13-17-33(57)18-14-31)41(61)49-25-39(59)53-37(23-29-9-5-3-6-10-29)45(65)55-56-46(66)38(24-30-11-7-4-8-12-30)54-40(60)26-50-42(62)28(2)52-44(64)36(48)22-32-15-19-34(58)20-16-32/h3-20,27-28,35-38,57-58H,21-26,47-48H2,1-2H3,(H,49,61)(H,50,62)(H,51,63)(H,52,64)(H,53,59)(H,54,60)(H,55,65)(H,56,66)/t27-,28+,35-,36-,37-,38-/m0/s1

• Std. InChIKey

  DESSEGDLRYOPTJ-LWXVJZBWSA-N

• Cite this record

  CSID:30845753, http://www.chemspider.com/Chemical-Structure.30845753.html (accessed 06:46, May 25, 2024)