Chem
J-GLOBAL ID:200907049645272926   Nikkaji number:J2.417.445J

(14β)-2,2,16,16-Tetrakis(phenylsulfonyl)-12-methylenegonane-4,8-diene

(14β)-2,2,16,16-テトラキス(フェニルスルホニル)-12-メチレンゴナン-4,8-ジエン
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: C42H40O8S4
Molecular formula furigana: C42-H40-O8-S4
Molecular weight: 801.010
InChI: InChI=1S/C42H40O8S4/c1-30-26-37-36(40-29-42(27-38(30)40,53(47,48)34-18-10-4-11-19-34)54(49,50)35-20-12-5-13-21-35)23-22-31-24-25-41(28-39(31)37,51(43,44)32-14-6-2-7-15-32)52(45,46)33-16-8-3-9-17-33/h2-21,24,38-40H,1,22-23,25-29H2/t38-,39-,40+/m0/s1
InChI key: GOCMEIPHZCZPCJ-XUTHUYCTSA-N
SMILES: C=C1CC2=C(CCC3=CCC(C[C@H]23)(S(=O)(=O)c2ccccc2)S(=O)(=O)c2ccccc2)[C@H]2CC(C[C@@H]12)(S(=O)(=O)c1ccccc1)S(=O)(=O)c1ccccc1
Systematic name  (3):
  • (14β)-2,2,16,16-テトラキス(フェニルスルホニル)-12-メチレンゴナン-4,8-ジエン
  • {[(3aS,9aS,11aR)-2,2,8-トリス(ベンゼンスルホニル)-11-メチリデン-1H,2H,3H,3aH,4H,5H,7H,8H,9H,9aH,10H,11H,11aH-シクロペンタ[a]フェナントレン-8-イル]スルホニル}ベンゼン
  • {[(3aS,9aS,11aR)-2,2,8-tris(benzenesulfonyl)-11-methylidene-1H,2H,3H,3aH,4H,5H,7H,8H,9H,9aH,10H,11H,11aH-cyclopenta[a]phenanthren-8-yl]sulfonyl}benzene
Other name (1):
  • (14β)-2,2,16,16-Tetrakis(phenylsulfonyl)-12-methylenegonane-4,8-diene
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