Chem
J-GLOBAL ID:200907060316280881   Nikkaji number:J2.309.112G

Madangamine E

マダンガミンE
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: C28H46N2
Molecular formula furigana: C28-H46-N2
Molecular weight: 410.690
InChI: InChI=1S/C28H46N2/c1-2-5-9-13-17-29-21-25-19-24-15-11-7-3-6-10-14-18-30-23-28(22-29,16-12-8-4-1)26(25)20-27(24)30/h3,7,15,25-27H,1-2,4-6,8-14,16-23H2/b7-3-,24-15-/t25-,26-,27+,28+/m1/s1
InChI key: GLHSTLLNLJNYMI-RCYOKJDDSA-N
SMILES: C1[C@@H]2N3C[C@]45CN(C[C@@H](C/C/2=C/C/C=C\CCCC3)[C@@H]14)CCCCCCCCCC5
Systematic name  (3):
  • (3S,4aR,5S,8aS)-5,3,2-[(2Z,5Z)-2,5-デカジエン-1,2,10-トリイル]-7,8a-(デカン-1,10-ジイル)デカヒドロ-2,7-ナフチリジン
  • (1S,2R,4S,10Z,13Z,16S)-5,18-ジアザペンタシクロ[16.10.1.11,5.02,16.04,14]トリアコンタ-10,13-ジエン
  • (1S,2R,4S,10Z,13Z,16S)-5,18-diazapentacyclo[16.10.1.11,5.02,16.04,14]triaconta-10,13-diene
Other name (3):
  • (3S,4aR,5S,8aS)-5,3,2-[(2Z,5Z)-2,5-Decadiene-1,2,10-triyl]-7,8a-(decane-1,10-diyl)decahydro-2,7-naphthyridine
  • マダンガミンE
  • Madangamine E
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