Chem
J-GLOBAL ID：200907084964385539   Nikkaji number：J1.249.392D

Okaramine O

オカラミンO
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： C32H34N4O4
Molecular formula furigana： C32-H34-N4-O4
Molecular weight： 538.648
InChI： InChI=1S/C32H34N4O4/c1-6-31(4,5)36-21-14-10-8-12-19(21)32(40)17-22-27(38)34-16-15-30(2,3)26-23(18-11-7-9-13-20(18)33-26)25(37)24(34)28(39)35(22)29(32)36/h6-16,22,24-25,29,33,37,40H,1,17H2,2-5H3/t22-,24-,25-,29-,32-/m0/s1
InChI key： AGEIPFHTGOFAIQ-VOUKVCSVSA-N
SMILES： CC(C)(C=C)N1[C@@H]2N3[C@@H](C[C@]2(O)c2ccccc12)C(=O)N1C=CC(C)(C)c2[nH]c4ccccc4c2[C@H](O)[C@H]1C3=O
Systematic name  (3)：
  • (10aS)-6,6-ジメチル-11aβ,19β-ジヒドロキシ-16-(1,1-ジメチル-2-プロペニル)-6,10,10aβ,11,11a,16,16aβ,18,18aβ,19-デカヒドロ-5H-インドロ[3′′′,2′′′:4′′,5′′]ピロロ[1′′,2′′:4′,5′]ピラジノ[1′,2′:1,2]アゾシノ[5,4-b]インドール-10,18-ジオン
  • (1S,4R,12S,14S,29S)-12,29-ジヒドロキシ-19,19-ジメチル-5-(2-メチルブタ-3-エン-2-イル)-3,5,16,21-テトラアザヘプタシクロ[14.13.0.03,14.04,12.06,11.020,28.022,27]ノナコサ-6,8,10,17,20(28),22,24,26-オクタエン-2,15-ジオン
  • (1S,4R,12S,14S,29S)-12,29-dihydroxy-19,19-dimethyl-5-(2-methylbut-3-en-2-yl)-3,5,16,21-tetraazaheptacyclo[14.13.0.03,14.04,12.06,11.020,28.022,27]nonacosa-6,8,10,17,20(28),22,24,26-octaene-2,15-dione
Other name (3)：
  • (10aS)-6,6-Dimethyl-11aβ,19β-dihydroxy-16-(1,1-dimethyl-2-propenyl)-6,10,10aβ,11,11a,16,16aβ,18,18aβ,19-decahydro-5H-indolo[3′′′,2′′′:4′′,5′′]pyrrolo[1′′,2′′:4′,5′]pyrazino[1′,2′:1,2]azocino[5,4-b]indole-10,18-dione
  • オカラミンO
  • Okaramine O
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