Chem
J-GLOBAL ID：201107062269263290   Nikkaji number：J2.995.526C

(4aS)-5-Hydroxy-6-methoxy-8-bromo-11-methyl-10aα,4aα-(epiminoethano)-3,4,4a,9,10,10a-hexahydrophenanthrene-3-one

(4aS)-5-ヒドロキシ-6-メトキシ-8-ブロモ-11-メチル-10aα,4aα-(エピミノエタノ)-3,4,4a,9,10,10a-ヘキサヒドロフェナントレン-3-オン
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： C18H20BrNO3
Molecular formula furigana： C18-H20-BR-N-O3
Molecular weight： 378.266
InChI： InChI=1S/C18H20BrNO3/c1-20-8-7-17-10-11(21)3-5-18(17,20)6-4-12-13(19)9-14(23-2)16(22)15(12)17/h3,5,9,22H,4,6-8,10H2,1-2H3/t17-,18-/m0/s1
InChI key： WBODGGOFPCDWQV-ROUUACIJSA-N
SMILES： COc1cc(Br)c2CC[C@@]34C=CC(=O)C[C@@]3(CCN4C)c2c1O
Systematic name  (3)：
  • (4aS)-5-ヒドロキシ-6-メトキシ-8-ブロモ-11-メチル-10aα,4aα-(エピミノエタノ)-3,4,4a,9,10,10a-ヘキサヒドロフェナントレン-3-オン
  • (1S,10R)-6-ブロモ-3-ヒドロキシ-4-メトキシ-17-メチル-17-アザテトラシクロ[8.4.3.01,10.02,7]ヘプタデカ-2,4,6,11-テトラエン-13-オン
  • (1S,10R)-6-bromo-3-hydroxy-4-methoxy-17-methyl-17-azatetracyclo[8.4.3.01,10.02,7]heptadeca-2,4,6,11-tetraen-13-one
Other name (1)：
  • (4aS)-5-Hydroxy-6-methoxy-8-bromo-11-methyl-10aα,4aα-(epiminoethano)-3,4,4a,9,10,10a-hexahydrophenanthrene-3-one
Thsaurus map：
Thesaurus Map

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