Chem
J-GLOBAL ID：200907030399273893   Nikkaji number：J626.072A

Beauverolide L

ベアウベロリドL
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： C29H45N3O5
Molecular formula furigana： C29-H45-N3-O5
Molecular weight： 515.695
InChI： InChI=1S/C29H45N3O5/c1-6-7-8-10-13-20(4)25-18-26(33)31-23(17-22-14-11-9-12-15-22)28(35)30-21(5)27(34)32-24(16-19(2)3)29(36)37-25/h9,11-12,14-15,19-21,23-25H,6-8,10,13,16-18H2,1-5H3,(H,30,35)(H,31,33)(H,32,34)/t20?,21-,23-,24?,25?/m0/s1
InChI key： GWWZRNBLQTXNPF-PYFKDDITSA-N
SMILES： CCCCCCC(C)C1CC(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)NC(CC(C)C)C(=O)O1
Systematic name  (4)：
  • N-[N-[N-(3-ヒドロキシ-4-メチル-1-オキソデシル)-L-フェニルアラニル]-L-アラニル]-D-ロイシンλ-ラクトン
  • N-[N-[N-(3-ヒドロキシ-4-メチルデカノイル)-L-フェニルアラニル]-L-アラニル]-D-ロイシンλ-ラクトン
  • (3R,6S,9S)-9-ベンジル-6-メチル-3-(2-メチルプロピル)-13-(オクタン-2-イル)-1-オキサ-4,7,10-トリアザシクロトリデカン-2,5,8,11-テトラオン
  • (3R,6S,9S)-9-benzyl-6-methyl-3-(2-methylpropyl)-13-(octan-2-yl)-1-oxa-4,7,10-triazacyclotridecane-2,5,8,11-tetrone
Other name (6)：
  • ベアウベロリドL
  • Beauverolide L
  • N-[N-[N-(3-Hydroxy-4-methyl-1-oxodecyl)-L-phenylalanyl]-L-alanyl]-D-leucine λ-lactone
  • N-[N-[N-(3-Hydroxy-4-methyldecanoyl)-L-phenylalanyl]-L-alanyl]-D-leucine λ-lactone
  • ベアウベリオリドII
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