Chem
J-GLOBAL ID：200907065972215265   Nikkaji number：J2.182.504B

Hirsutellone B

ヒルステロンB
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： C28H33NO4
Molecular formula furigana： C28-H33-N-O4
Molecular weight： 447.575
InChI： InChI=1S/C28H33NO4/c1-3-17-7-11-19-21-12-15(2)4-10-20(21)26-24(19)23(17)25(30)22-14-28(32,29-27(22)31)13-16-5-8-18(33-26)9-6-16/h3,5-9,11,15,17,19-24,26,32H,1,4,10,12-14H2,2H3,(H,29,31)/t15-,17+,19+,20-,21+,22+,23+,24+,26+,28-/m1/s1
InChI key： VGNDUPFGVMMKPS-KOSFCWFBSA-N
SMILES： C[C@@H]1CC[C@@H]2[C@@H](C1)[C@@H]1C=C[C@H](C=C)[C@H]3[C@H]1[C@H]2Oc1ccc(C[C@@]2(O)C[C@H](C(=O)N2)C3=O)cc1
Systematic name  (3)：
  • (2S,4S)-2,4-[メチレン(4,1-フェニレン)オキシ[(1S,2S,4aS,4bS,6R,8aR,9S,9aS)-2-エテニル-1,2,4a,4b,5,6,7,8,8a,9a-デカヒドロ-6-メチル-9H-フルオレン-9,1-ジイル]カルボニル]-2-ヒドロキシピロリジン-5-オン
  • (3S,4R,7R,9S,10S,13S,14S,16S,19S,27S)-13-エテニル-19-ヒドロキシ-7-メチル-2-オキサ-18-アザヘキサシクロ[19.2.2.13,10.116,19.04,9.014,27]ヘプタコサ-1(23),11,21,24-テトラエン-15,17-ジオン
  • (3S,4R,7R,9S,10S,13S,14S,16S,19S,27S)-13-ethenyl-19-hydroxy-7-methyl-2-oxa-18-azahexacyclo[19.2.2.13,10.116,19.04,9.014,27]heptacosa-1(23),11,21,24-tetraene-15,17-dione
Other name (3)：
  • (2S,4S)-2,4-[Methylene(4,1-phenylene)oxy[(1S,2S,4aS,4bS,6R,8aR,9S,9aS)-2-ethenyl-1,2,4a,4b,5,6,7,8,8a,9a-decahydro-6-methyl-9H-fluorene-9,1-diyl]carbonyl]-2-hydroxypyrrolidine-5-one
  • ヒルステロンB
  • Hirsutellone B
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