Chem
J-GLOBAL ID：200907061599020755   Nikkaji number：J1.711.473E

Hyperibone B

ヒペリボン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： C33H42O5
Molecular formula furigana： C33-H42-O5
Molecular weight： 518.693
InChI： InChI=1S/C33H42O5/c1-20(2)14-15-23-19-32(17-16-21(3)4)28-24(18-25(38-28)31(7,8)37)27(35)33(29(32)36,30(23,5)6)26(34)22-12-10-9-11-13-22/h9-14,16,23,25,37H,15,17-19H2,1-8H3/t23-,25-,32-,33+/m1/s1
InChI key： PHBDYBJOGVFIQU-XXASJIQDSA-N
SMILES： CC(=CC[C@@H]1C[C@]2(CC=C(C)C)C3=C(C[C@@H](O3)C(C)(C)O)C(=O)[C@@](C(=O)c3ccccc3)(C2=O)C1(C)C)C
Systematic name  (3)：
  • (2R)-2β-(1-ヒドロキシ-1-メチルエチル)-5α-ベンゾイル-6,6-ジメチル-7α,9α-ビス(3-メチル-2-ブテニル)-2,3,6,7,8,9-ヘキサヒドロ-5,9-メタノシクロオクタ[b]フラン-4,10(5H)-ジオン
  • (1R,4R,8R,10R)-8-ベンゾイル-4-(2-ヒドロキシプロパン-2-イル)-9,9-ジメチル-1,10-ビス(3-メチルブタ-2-エン-1-イル)-3-オキサトリシクロ[6.3.1.02,6]ドデカ-2(6)-エン-7,12-ジオン
  • (1R,4R,8R,10R)-8-benzoyl-4-(2-hydroxypropan-2-yl)-9,9-dimethyl-1,10-bis(3-methylbut-2-en-1-yl)-3-oxatricyclo[6.3.1.02,6]dodec-2(6)-ene-7,12-dione
Other name (3)：
  • (2R)-2β-(1-Hydroxy-1-methylethyl)-5α-benzoyl-6,6-dimethyl-7α,9α-bis(3-methyl-2-butenyl)-2,3,6,7,8,9-hexahydro-5,9-methanocycloocta[b]furan-4,10(5H)-dione
  • ヒペリボンB
  • Hyperibone B
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