Chem
J-GLOBAL ID：200907050622324315   Nikkaji number：J12.337D

Retrorsine

レトロルシン
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： C18H25NO6
Molecular formula furigana： C18-H25-N-O6
Molecular weight： 351.399
InChI： InChI=1S/C18H25NO6/c1-3-12-8-11(2)18(23,10-20)17(22)24-9-13-4-6-19-7-5-14(15(13)19)25-16(12)21/h3-4,11,14-15,20,23H,5-10H2,1-2H3/b12-3-/t11-,14-,15-,18-/m1/s1
InChI key： BCJMNZRQJAVDLD-CQRYIUNCSA-N
SMILES： C/C=C\1/C[C@@H](C)[C@](O)(CO)C(=O)OCC2=CCN3CC[C@@H](OC1=O)[C@@H]23
Systematic name  (3)：
  • 12,18-ジヒドロキシセネシオナン-11,16-ジオン
  • (1R,4Z,6R,7S,17R)-4-エチリデン-7-ヒドロキシ-7-(ヒドロキシメチル)-6-メチル-2,9-ジオキサ-14-アザトリシクロ[9.5.1.014,17]ヘプタデカ-11-エン-3,8-ジオン
  • (1R,4Z,6R,7S,17R)-4-ethylidene-7-hydroxy-7-(hydroxymethyl)-6-methyl-2,9-dioxa-14-azatricyclo[9.5.1.014,17]heptadec-11-ene-3,8-dione
Other name (5)：
  • レトロルシン
  • β-ロンギロビン
  • Retrorsine
  • β-Longilobine
  • 12,18-Dihydroxysenecionan-11,16-dione
CAS registry number： 480-54-6
KEGG COMPOUND： C10364
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