Chem
J-GLOBAL ID:200907049389764808   Nikkaji number:J1.274.739J

(3S,12aR)-7α,10,10-Trimethyl-4,4aα,4bβ,5aβ,6,8,9,9aα,10,12-decahydro-3H-3β,12a-epoxy-7H-isoindolo[1,2-b][1,3]benzoxazine

(1R,5S,8R,10R,12S,13R,15S)-4,4,8-トリメチル-11,18-ジオキサ-3-アザペンタシクロ[13.2.1.01,13.03,12.05,10]オクタデカ-16-エン
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: C18H27NO2
Molecular formula furigana: C18-H27-N-O2
Molecular weight: 289.419
InChI: InChI=1S/C18H27NO2/c1-11-4-5-13-15(8-11)20-16-14-9-12-6-7-18(14,21-12)10-19(16)17(13,2)3/h6-7,11-16H,4-5,8-10H2,1-3H3/t11-,12-,13-,14+,15-,16+,18+/m1/s1
InChI key: FAWWAMYCAMCLCL-SXWCTKSRSA-N
SMILES: C[C@@H]1CC[C@@H]2[C@@H](C1)O[C@H]1[C@@H]3C[C@@H]4O[C@]3(CN1C2(C)C)C=C4
Systematic name  (3):
  • (3S,12aR)-7α,10,10-トリメチル-4,4aα,4bβ,5aβ,6,8,9,9aα,10,12-デカヒドロ-3H-3β,12a-エポキシ-7H-イソインドロ[1,2-b][1,3]ベンゾオキサジン
  • (1R,5S,8R,10R,12S,13R,15S)-4,4,8-トリメチル-11,18-ジオキサ-3-アザペンタシクロ[13.2.1.01,13.03,12.05,10]オクタデカ-16-エン
  • (1R,5S,8R,10R,12S,13R,15S)-4,4,8-trimethyl-11,18-dioxa-3-azapentacyclo[13.2.1.01,13.03,12.05,10]octadec-16-ene
Other name (1):
  • (3S,12aR)-7α,10,10-Trimethyl-4,4aα,4bβ,5aβ,6,8,9,9aα,10,12-decahydro-3H-3β,12a-epoxy-7H-isoindolo[1,2-b][1,3]benzoxazine
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