Chem
J-GLOBAL ID：200907012520125181   Nikkaji number：J1.350.893C

Blazeispirol Y

ブラゼイスピロールY
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： C28H36O5
Molecular formula furigana： C28-H36-O5
Molecular weight： 452.591
InChI： InChI=1S/C28H36O5/c1-15-18-9-12-27(33-28(15)23(31)16(2)24(3,4)32-28)20-14-22(30)21-13-17(29)7-10-25(21,5)19(20)8-11-26(18,27)6/h8,11,13-16,18-19,23,31H,7,9-10,12H2,1-6H3/t15-,16-,18+,19?,23+,25+,26+,27-,28-/m0/s1
InChI key： IXEQCBQJCGQVRZ-KVHUHIMYSA-N
SMILES： C[C@H]1[C@@H](O)[C@@]2(OC1(C)C)O[C@]13CC[C@H]([C@@H]2C)[C@@]1(C)C=CC1C3=CC(=O)C2=CC(=O)CC[C@]12C
Systematic name  (3)：
  • (1R,3S)-2α,4′α,5′,5′,10aβ,12aβ-ヘキサメチル-3′α-ヒドロキシ-1α,4aα-エタノ-1,2,4a,6,8,9,10,10a,10b,12a-デカヒドロスピロ[3H-フェナントロ[1,2-b]ピラン-3,2′-オキソラン]-6,8-ジオン
  • (1'S,2S,3R,4S,10'R,14'R,15'R,16'S)-3-ヒドロキシ-4,5,5,10',14',16'-ヘキサメチル-18'-オキサスピロ[オキソラン-2,17'-ペンタシクロ[13.3.2.01,14.02,11.05,10]イコサン]-2',5',12'-トリエン-4',7'-ジオン
  • (1'S,2S,3R,4S,10'R,14'R,15'R,16'S)-3-hydroxy-4,5,5,10',14',16'-hexamethyl-18'-oxaspiro[oxolane-2,17'-pentacyclo[13.3.2.01,14.02,11.05,10]icosane]-2',5',12'-triene-4',7'-dione
Other name (3)：
  • (1R,3S)-2α,4′α,5′,5′,10aβ,12aβ-Hexamethyl-3′α-hydroxy-1α,4aα-ethano-1,2,4a,6,8,9,10,10a,10b,12a-decahydrospiro[3H-phenanthro[1,2-b]pyran-3,2′-oxolane]-6,8-dione
  • ブラゼイスピロールY
  • Blazeispirol Y
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