Chem
J-GLOBAL ID:200907076974520083   Nikkaji number:J2.527.867D

Cordyheptapepitde B

コルジヘプタペプチドB
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: C49H65N7O7
Molecular formula furigana: C49-H65-N7-O7
Molecular weight: 864.101
InChI: InChI=1S/C49H65N7O7/c1-8-33(4)43-45(59)51-37(27-32(2)3)46(60)55(7)41(30-36-23-16-11-17-24-36)49(63)56-26-18-25-39(56)48(62)53(5)31-42(57)50-38(28-34-19-12-9-13-20-34)47(61)54(6)40(44(58)52-43)29-35-21-14-10-15-22-35/h9-17,19-24,32-33,37-41,43H,8,18,25-31H2,1-7H3,(H,50,57)(H,51,59)(H,52,58)/t33-,37-,38-,39-,40-,41+,43-/m0/s1
InChI key: UVPLWQIDJSLMEL-JXSFLUKESA-N
SMILES: CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@H](Cc2ccccc2)NC(=O)CN(C)C(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccccc2)N(C)C(=O)[C@H](CC(C)C)NC1=O
Systematic name  (3):
  • シクロ(L-Ile-L-Leu-N-メチル-D-Phe-L-Pro-N-メチル-Gly-L-Phe-N-メチル-L-Phe-)
  • (6S,9S,12S,15S,18R,23aS)-6,9,18-トリベンジル-12-[(2S)-ブタン-2-イル]-2,8,17-トリメチル-15-(2-メチルプロピル)-ドコサヒドロ-1H-ピロロ[1,2-a]1,4,7,10,13,16,19-ヘプタアザシクロヘンイコサン-1,4,7,10,13,16,19-ヘプタオン
  • (6S,9S,12S,15S,18R,23aS)-6,9,18-tribenzyl-12-[(2S)-butan-2-yl]-2,8,17-trimethyl-15-(2-methylpropyl)-docosahydro-1H-pyrrolo[1,2-a]1,4,7,10,13,16,19-heptaazacyclohenicosane-1,4,7,10,13,16,19-heptone
Other name (3):
  • Cyclo(L-Ile-L-Leu-N-methyl-D-Phe-L-Pro-N-methyl-Gly-L-Phe-N-methyl-L-Phe-)
  • コルジヘプタペプチドB
  • Cordyheptapepitde B
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