Chem
J-GLOBAL ID：200907015148519959   Nikkaji number：J2.100.537A

Lundurine B

ルンズリン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： C21H24N2O3
Molecular formula furigana： C21-H24-N2-O3
Molecular weight： 352.434
InChI： InChI=1S/C21H24N2O3/c1-25-14-4-5-16-15(12-14)20-9-11-22-10-3-6-19(22)7-8-21(20,17(20)13-19)23(16)18(24)26-2/h3-6,12,17H,7-11,13H2,1-2H3/t17-,19+,20-,21+/m0/s1
InChI key： NWRQSGIXMCIMBT-FYZZASKESA-N
SMILES： COC(=O)N1c2ccc(OC)cc2[C@]23CCN4CC=C[C@@]54CC[C@]12[C@H]3C5
Systematic name  (3)：
  • (3aR,8aR,10aR)-8a,3a,10a-[(2S)-エタン-1-イル-2-イリデン]-12-メトキシ-2,3-[1,3]ブタジエノ-1,3a,4,5,6,8a,9,10,10a-ノナヒドロ-1,5a-ジアザジシクロペンタ[a,e]シクロオクテン-1-カルボン酸メチル
  • メチル (1R,9R,12R,19S)-4-メトキシ-8,16-ジアザヘキサシクロ[10.6.2.01,9.02,7.09,19.012,16]イコサ-2,4,6,13-テトラエン-8-カルボキシラート
  • methyl (1R,9R,12R,19S)-4-methoxy-8,16-diazahexacyclo[10.6.2.01,9.02,7.09,19.012,16]icosa-2,4,6,13-tetraene-8-carboxylate
Other name (5)：
  • (3aR,8aR,10aR)-8a,3a,10a-[(2S)-Ethane-1-yl-2-ylidene]-12-methoxy-2,3-[1,3]butadieno-1,3a,4,5,6,8a,9,10,10a-nonahydro-1,5a-diazadicyclopenta[a,e]cyclooctene-1-carboxylic acid methyl ester
  • ルンズリンB
  • Lundurine B
  • (-)-Lundurine B
  • (-)-ルンズリンB
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