CAS 296248-30-1 | L-Valine, L-histidyl-L-threonyl-L-glutaminyl-L-isoleucyl-L-threonyl-L-lysyl- (9CI) | CAS Number 296248-30-1

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296248-30-1 | L-Valine, L-histidyl-L-threonyl-L-glutaminyl-L-isoleucyl-L-threonyl-L-lysyl- (9CI)

CAS No: 296248-30-1 Catalog No: AG002YXE MDL No:

Product Description

Catalog Number:

AG002YXE

Chemical Name:

L-Valine, L-histidyl-L-threonyl-L-glutaminyl-L-isoleucyl-L-threonyl-L-lysyl- (9CI)

CAS Number:

296248-30-1

Molecular Formula:

C36H63N11O11

Molecular Weight:

825.9525

IUPAC Name:

(2S)-2-[[(2S)-6-amino-2-[[(2S,3R)-2-[[(2S,3S)-2-[[(2S)-5-amino-2-[[(2S,3R)-2-[[(2S)-2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]-3-hydroxybutanoyl]amino]-5-oxopentanoyl]amino]-3-methylpentanoyl]amino]-3-hydroxybutanoyl]amino]hexanoyl]amino]-3-methylbutanoic acid

InChI:

InChI=1S/C36H63N11O11/c1-7-18(4)27(33(54)47-29(20(6)49)35(56)42-23(10-8-9-13-37)31(52)44-26(17(2)3)36(57)58)45-32(53)24(11-12-25(39)50)43-34(55)28(19(5)48)46-30(51)22(38)14-21-15-40-16-41-21/h15-20,22-24,26-29,48-49H,7-14,37-38H2,1-6H3,(H2,39,50)(H,40,41)(H,42,56)(H,43,55)(H,44,52)(H,45,53)(H,46,51)(H,47,54)(H,57,58)/t18-,19+,20+,22-,23-,24-,26-,27-,28-,29-/m0/s1

InChI Key:

YLANSBCLGSBCLZ-ZIGCIBDXSA-N

SMILES:

NCCCC[C@@H](C(=O)N[C@H](C(=O)O)C(C)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](Cc1nc[nH]c1)N)CCC(=O)N