Chem
J-GLOBAL ID:200907048695721989   Nikkaji number:J922.769E

(1S,13R,14R,15S,18S)-2,6-Metheno-4,18-decano-13,15-propano-4,15-diazabicyclo[12.3.1]octadecan-32-one

(1S,13R,14R,15S,18S)-2,6-メテノ-4,18-デカノ-13,15-プロパノ-4,15-ジアザビシクロ[12.3.1]オクタデカン-32-オン
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: C30H50N2O
Molecular formula furigana: C30-H50-N2-O
Molecular weight: 454.743
InChI: InChI=1S/C30H50N2O/c33-29-17-20-32-19-16-26-25-21-24-13-9-6-7-11-15-28(29)30(32)27(26)14-10-5-3-1-2-4-8-12-18-31(22-24)23-25/h21,25-28,30H,1-20,22-23H2/t25?,26-,27-,28-,30+/m0/s1
InChI key: WTUWNHMLLRTMAH-BFIWIABYSA-N
SMILES: O=C1CCN2CC[C@H]3C4CN5CC(=C4)CCCCCC[C@@H]1[C@H]2[C@H]3CCCCCCCCCC5
Systematic name  (3):
  • (1S,13R,14R,15S,18S)-2,6-メテノ-4,18-デカノ-13,15-プロパノ-4,15-ジアザビシクロ[12.3.1]オクタデカン-32-オン
  • (1R,23S,24S,31R)-12,27-ジアザペンタシクロ[21.7.1.18,12.010,24.027,31]ドトリアコンタ-8-エン-30-オン
  • (1R,23S,24S,31R)-12,27-diazapentacyclo[21.7.1.18,12.010,24.027,31]dotriacont-8-en-30-one
Other name (1):
  • (1S,13R,14R,15S,18S)-2,6-Metheno-4,18-decano-13,15-propano-4,15-diazabicyclo[12.3.1]octadecan-32-one
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