Chem
J-GLOBAL ID：200907024244838169   Nikkaji number：J91.863F

Beauverolide A

ベアウベロリドA
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： C30H47N3O5
Molecular formula furigana： C30-H47-N3-O5
Molecular weight： 529.722
InChI： InChI=1S/C30H47N3O5/c1-7-8-9-11-14-21(6)24-18-25(34)31-23(17-22-15-12-10-13-16-22)28(35)32-26(19(2)3)29(36)33-27(20(4)5)30(37)38-24/h10,12-13,15-16,19-21,23-24,26-27H,7-9,11,14,17-18H2,1-6H3,(H,31,34)(H,32,35)(H,33,36)/t21?,23-,24?,26-,27?/m0/s1
InChI key： PDYJABXOYRNPHH-ANJSZYJVSA-N
SMILES： CCCCCCC(C)C1CC(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C(C)C)C(=O)NC(C(C)C)C(=O)O1
Systematic name  (3)：
  • 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-バリル]-L-バリンλ-ラクトン
  • (3S,6S,9S)-9-ベンジル-13-(オクタン-2-イル)-3,6-ビス(プロパン-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
  • (3S,6S,9S)-9-benzyl-13-(octan-2-yl)-3,6-bis(propan-2-yl)-1-oxa-4,7,10-triazacyclotridecane-2,5,8,11-tetrone
Other name (3)：
  • Beauverolide A
  • ベアウベロリドA
  • N-[N-[N-(3-Hydroxy-4-methyl-1-oxodecyl)-L-phenylalanyl]-L-valyl]-L-valine λ-lactone
CAS registry number： 75920-37-5
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM