Chem
J-GLOBAL ID：200907088885528222   Nikkaji number：J1.324.389A

(1S)-N-[(9S)-Cinchonan-9-yl]-4α,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1α-carboxamide

(1S)-N-[(9S)-シンコナン-9-イル]-4α,7,7-トリメチル-3-オキソ-2-オキサビシクロ[2.2.1]ヘプタン-1α-カルボアミド
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： C29H35N3O3
Molecular formula furigana： C29-H35-N3-O3
Molecular weight： 473.617
InChI： InChI=1S/C29H35N3O3/c1-5-18-17-32-15-11-19(18)16-23(32)24(21-10-14-30-22-9-7-6-8-20(21)22)31-25(33)29-13-12-28(4,26(34)35-29)27(29,2)3/h5-10,14,18-19,23-24H,1,11-13,15-17H2,2-4H3,(H,31,33)/t18-,19-,23+,24-,28-,29+/m0/s1
InChI key： KVBOUJAPQBUOHF-UPSSFQELSA-N
SMILES： CC1(C)[C@@]2(C)CC[C@@]1(OC2=O)C(=O)N[C@H]([C@H]1C[C@@H]2CCN1C[C@@H]2C=C)c1ccnc2ccccc12
Systematic name  (3)：
  • (1S)-N-[(9S)-シンコナン-9-イル]-4α,7,7-トリメチル-3-オキソ-2-オキサビシクロ[2.2.1]ヘプタン-1α-カルボアミド
  • (1S,4R)-N-[(S)-[(2R,4S,5R)-5-エテニル-1-アザビシクロ[2.2.2]オクタン-2-イル](キノリン-4-イル)メチル]-4,7,7-トリメチル-3-オキソ-2-オキサビシクロ[2.2.1]ヘプタン-1-カルボキサミド
  • (1S,4R)-N-[(S)-[(2R,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl](quinolin-4-yl)methyl]-4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carboxamide
Other name (1)：
  • (1S)-N-[(9S)-Cinchonan-9-yl]-4α,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1α-carboxamide
Thsaurus map：
Thesaurus Map

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