Chem
J-GLOBAL ID：200907043687105274   Nikkaji number：J1.062.399E

Okaramine H

オカラミンH
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： C32H32N4O3
Molecular formula furigana： C32-H32-N4-O3
Molecular weight： 520.633
InChI： InChI=1S/C32H32N4O3/c1-19(2)13-15-35-24-12-8-6-10-22(24)32(39)18-26-28(37)34-16-14-31(3,4)27-21(20-9-5-7-11-23(20)33-27)17-25(34)29(38)36(26)30(32)35/h5-14,16-17,26,30,33,39H,15,18H2,1-4H3/b16-14?,25-17-/t26-,30+,32-/m1/s1
InChI key： FMCOJPLWUMWVIO-QIXSILHDSA-N
SMILES： CC(=CCN1[C@H]2N3[C@H](C[C@@]2(O)c2ccccc12)C(=O)N1C=CC(C)(C)c2[nH]c4ccccc4c2C=C1C3=O)C
Systematic name  (3)：
  • (10aR)-16-(3-メチル-2-ブテニル)-11,11a,16,16aα-テトラヒドロ-11aα-ヒドロキシ-6,6-ジメチル-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(6H,10aH)-ジオン
  • (1Z,4S,12R,14R)-12-ヒドロキシ-19,19-ジメチル-5-(3-メチルブタ-2-エン-1-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-1(29),6,8,10,17,20(28),22,24,26-ノナエン-2,15-ジオン
  • (1Z,4S,12R,14R)-12-hydroxy-19,19-dimethyl-5-(3-methylbut-2-en-1-yl)-3,5,16,21-tetraazaheptacyclo[14.13.0.03,14.04,12.06,11.020,28.022,27]nonacosa-1(29),6,8,10,17,20(28),22,24,26-nonaene-2,15-dione
Other name (3)：
  • (10aR)-16-(3-Methyl-2-butenyl)-11,11a,16,16aα-tetrahydro-11aα-hydroxy-6,6-dimethyl-5H-indolo[3′′′,2′′′:4′′,5′′]pyrrolo[1′′,2′′:4′,5′]pyrazino[1′,2′:1,2]azocino[5,4-b]indole-10,18(6H,10aH)-dione
  • オカラミンH
  • Okaramine H
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