Chem
J-GLOBAL ID：200907056729591039   Nikkaji number：J2.463.366G

(1S,3R,6Z,8Z,10Z,14R,16S,30S,31R)-3,16-Diazatetracyclo[14.12.5.13,30.014,31]tetratriacontane-6,8,10-triene-5-ol

(4Z,6Z,8Z,12R,13R,29S,31S)-1,16-ジアザテトラシクロ[27.3.1.112,16.013,31]テトラトリアコンタ-4,6,8-トリエン-3-オール
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： C32H54N2O
Molecular formula furigana： C32-H54-N2-O
Molecular weight： 482.797
InChI： InChI=1S/C32H54N2O/c35-31-19-15-11-7-6-10-14-18-29-25-33-21-16-12-8-4-2-1-3-5-9-13-17-28-23-30(32(29)20-22-33)26-34(24-28)27-31/h6-7,10-11,15,19,28-32,35H,1-5,8-9,12-14,16-18,20-27H2/b10-6-,11-7-,19-15-/t28-,29-,30+,31?,32+/m0/s1
InChI key： FWLQTNCVIRJADS-IPHCVPHUSA-N
SMILES： OC1CN2C[C@@H]3C[C@H](C2)[C@@H]2CCN(C[C@@H]2CC/C=C\C=C/C=C\1)CCCCCCCCCCCC3
Systematic name  (3)：
  • (1S,3R,6Z,8Z,10Z,14R,16S,30S,31R)-3,16-ジアザテトラシクロ[14.12.5.13,30.014,31]テトラトリアコンタン-6,8,10-トリエン-5-オール
  • (4Z,6Z,8Z,12R,13R,29S,31S)-1,16-ジアザテトラシクロ[27.3.1.112,16.013,31]テトラトリアコンタ-4,6,8-トリエン-3-オール
  • (4Z,6Z,8Z,12R,13R,29S,31S)-1,16-diazatetracyclo[27.3.1.112,16.013,31]tetratriaconta-4,6,8-trien-3-ol
Other name (1)：
  • (1S,3R,6Z,8Z,10Z,14R,16S,30S,31R)-3,16-Diazatetracyclo[14.12.5.13,30.014,31]tetratriacontane-6,8,10-triene-5-ol
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