Chem
J-GLOBAL ID：200907059170466386   Nikkaji number：J948.174E

Rosmarinine

ロスマリニン
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： C18H27NO6
Molecular formula furigana： C18-H27-N-O6
Molecular weight： 353.415
InChI： InChI=1S/C18H27NO6/c1-4-11-7-10(2)18(3,23)17(22)24-9-12-13(20)8-19-6-5-14(15(12)19)25-16(11)21/h4,10,12-15,20,23H,5-9H2,1-3H3/b11-4-/t10-,12?,13?,14-,15-,18-/m1/s1
InChI key： YEXVXKIMPBHRQR-UMKISOJSSA-N
SMILES： C/C=C\1/C[C@@H](C)[C@@](C)(O)C(=O)OCC2C(O)CN3CC[C@@H](OC1=O)[C@@H]23
Systematic name  (3)：
  • 2,12-ジヒドロキシ-1,2-ジヒドロセネシオナン-11,16-ジオン
  • (1R,4Z,6R,7R,17R)-4-エチリデン-7,12-ジヒドロキシ-6,7-ジメチル-2,9-ジオキサ-14-アザトリシクロ[9.5.1.014,17]ヘプタデカン-3,8-ジオン
  • (1R,4Z,6R,7R,17R)-4-ethylidene-7,12-dihydroxy-6,7-dimethyl-2,9-dioxa-14-azatricyclo[9.5.1.014,17]heptadecane-3,8-dione
Other name (3)：
  • ロスマリニン
  • Rosmarinine
  • 2,12-Dihydroxy-1,2-dihydrosenecionan-11,16-dione
KEGG COMPOUND： C10380
Thsaurus map：
Thesaurus Map

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