Chem
J-GLOBAL ID：200907002238491080   Nikkaji number：J1.509.228I

6α,17α:8α,15α-Dimethano-6,8,15,17-tetrahydroheptacene

6α,17α:8α,15α-ジメタノ-6,8,15,17-テトラヒドロヘプタセン
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： C32H22
Molecular formula furigana： C32-H22
Molecular weight： 406.528
InChI： InChI=1S/C32H22/c1-2-6-18-10-22-21(9-17(18)5-1)25-13-26(22)30-16-32-28-14-27(31(32)15-29(25)30)23-11-19-7-3-4-8-20(19)12-24(23)28/h1-12,15-16,25-28H,13-14H2/t25-,26+,27+,28-
InChI key： VOUMKPJFKUPLNX-KXSOJQAOSA-N
SMILES： C1[C@H]2c3cc4[C@H]5C[C@@H](c4cc3[C@@H]1c1cc3ccccc3cc21)c1cc2ccccc2cc51
Systematic name  (3)：
  • 6α,17α:8α,15α-ジメタノ-6,8,15,17-テトラヒドロヘプタセン
  • (1R,5S,16R,20S)-ノナシクロ[18.10.1.15,16.02,19.04,17.06,15.08,13.021,30.023,28]ドトリアコンタ-2,4(17),6(15),7,9,11,13,18,21(30),22,24,26,28-トリデカエン
  • (1R,5S,16R,20S)-nonacyclo[18.10.1.15,16.02,19.04,17.06,15.08,13.021,30.023,28]dotriaconta-2,4(17),6(15),7,9,11,13,18,21(30),22,24,26,28-tridecaene
Other name (1)：
  • 6α,17α:8α,15α-Dimethano-6,8,15,17-tetrahydroheptacene
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