Chem
J-GLOBAL ID：200907067282348265   Nikkaji number：J389.963B

Polymyxin B nonapeptide

ポリミキシンBノナペプチド
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C43H74N14O11
Molecular formula furigana： C43-H74-N14-O11
Molecular weight： 963.152
InChI： InChI=1S/C43H74N14O11/c1-22(2)20-31-40(65)52-26(10-15-44)35(60)51-29(13-18-47)39(64)57-34(24(4)59)43(68)49-19-14-30(53-36(61)28(12-17-46)54-42(67)33(48)23(3)58)38(63)50-27(11-16-45)37(62)56-32(41(66)55-31)21-25-8-6-5-7-9-25/h5-9,22-24,26-34,58-59H,10-21,44-48H2,1-4H3,(H,49,68)(H,50,63)(H,51,60)(H,52,65)(H,53,61)(H,54,67)(H,55,66)(H,56,62)(H,57,64)/t23-,24-,26?,27+,28+,29+,30?,31?,32?,33+,34+/m1/s1
InChI key： PYHYGIPVYYRJHU-QLEWCOFWSA-N
SMILES： CC(C)CC1NC(=O)C(Cc2ccccc2)NC(=O)[C@H](CCN)NC(=O)C(CCNC(=O)[C@@H](NC(=O)[C@H](CCN)NC(=O)C(CCN)NC1=O)[C@@H](C)O)NC(=O)[C@H](CCN)NC(=O)[C@@H](N)[C@@H](C)O
Systematic name  (5)：
  • N2-(L-Thr-L-A2bu-)シクロ(L-A2bu*-L-A2bu-D-Phe-L-Leu-L-A2bu-L-A2bu-L-Thr-)
  • N2-(L-Thr-L-A2bu-)シクロ(L-A2bu*-L-A2bu-D-Phe-L-Leu-L-A2bu-L-A2bu-Thr-)
  • Nα-(L-Thr-L-A2bu-)シクロ(L-A2bu*-L-A2bu-D-Phe-L-Leu-L-A2bu-L-A2bu-L-Thr-)
  • (2S,3R)-2-アミノ-N-[(1S)-3-アミノ-1-{[(3S,6S,9S,12S,15R,18S,21S)-6,9,18-トリス(2-アミノエチル)-15-ベンジル-3-[(1R)-1-ヒドロキシエチル]-12-(2-メチルプロピル)-2,5,8,11,14,17,20-ヘプタオキソ-1,4,7,10,13,16,19-ヘプタアザシクロトリコサン-21-イル]カルバモイル}プロピル]-3-ヒドロキシブタンアミド
  • (2S,3R)-2-amino-N-[(1S)-3-amino-1-{[(3S,6S,9S,12S,15R,18S,21S)-6,9,18-tris(2-aminoethyl)-15-benzyl-3-[(1R)-1-hydroxyethyl]-12-(2-methylpropyl)-2,5,8,11,14,17,20-heptaoxo-1,4,7,10,13,16,19-heptaazacyclotricosan-21-yl]carbamoyl}propyl]-3-hydroxybutanamide
Other name (7)：
  • Polymyxin B nonapeptide
  • ポリミキシンBノナペプチド
  • PMBN
  • sPMBN
  • Nα-(L-Thr-L-A2bu-)Cyclo(L-A2bu*-L-A2bu-D-Phe-L-Leu-L-A2bu-L-A2bu-L-Thr-)
Show all
CAS registry number： 86408-36-8
Application (1)：
peptide antibiotics
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM