Chem
J-GLOBAL ID：200907072014555006   Nikkaji number：J7.900F

Rheadine

レアジン
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： C21H21NO6
Molecular formula furigana： C21-H21-N-O6
Molecular weight： 383.400
InChI： InChI=1S/C21H21NO6/c1-22-6-5-11-7-15-16(26-9-25-15)8-13(11)19-18(22)12-3-4-14-20(27-10-24-14)17(12)21(23-2)28-19/h3-4,7-8,18-19,21H,5-6,9-10H2,1-2H3/t18-,19-,21+/m1/s1
InChI key： XRBIHOLQAKITPP-SBHAEUEKSA-N
SMILES： CO[C@H]1O[C@H]2[C@H](N(C)CCc3cc4OCOc4cc23)c2ccc3OCOc3c12
Systematic name  (3)：
  • 8β-メトキシ-16-メチル-2,3:10,11-ビス[メチレンビス(オキシ)]レアダン
  • (1R,14R,24S)-24-メトキシ-13-メチル-5,7,19,21,25-ペンタオキサ-13-アザヘキサシクロ[12.11.0.02,10.04,8.015,23.018,22]ペンタコサ-2,4(8),9,15,17,22-ヘキサエン
  • (1R,14R,24S)-24-methoxy-13-methyl-5,7,19,21,25-pentaoxa-13-azahexacyclo[12.11.0.02,10.04,8.015,23.018,22]pentacosa-2,4(8),9,15,17,22-hexaene
Other name (5)：
  • レアジン
  • ロエアジン
  • Rheadine
  • Rhoeadine
  • 8β-Methoxy-16-methyl-2,3:10,11-bis[methylenebis(oxy)]rheadan
CAS registry number： 2718-25-4
KEGG COMPOUND： C09619
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