Chem
J-GLOBAL ID：200907084949909106   Nikkaji number：J1.479.313E

Blazeispirol C

ブラゼイスピロールC
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： C25H36O4
Molecular formula furigana： C25-H36-O4
Molecular weight： 400.559
InChI： InChI=1S/C25H36O4/c1-14-17-10-12-23(6)18-11-13-24(23,19(17)8-9-20(14)27-7)29-25(15(18)2)21(26)16(3)22(4,5)28-25/h8-9,15-16,18,21,26H,10-13H2,1-7H3/t15-,16-,18+,21+,23+,24-,25-/m0/s1
InChI key： QEVQGAGSLSJTLO-TVHHQFAESA-N
SMILES： COc1ccc2c(CC[C@]3(C)[C@@H]4CC[C@]23O[C@@]2(OC(C)(C)[C@@H](C)[C@H]2O)[C@H]4C)c1C
Systematic name  (3)：
  • (2S)-3′β,4α,4′aα,5,5,7′-ヘキサメチル-8′-メトキシ-4′β,10′bβ-エタノ-3′,4′,4′a,5′,6′,10′b-ヘキサヒドロスピロ[オキソラン-2,2′-[2H]ナフト[1,2-b]ピラン]-3α-オール
  • (1'R,2S,3R,4S,10'R,11'R,12'S)-5'-メトキシ-4,5,5,6',10',12'-ヘキサメチル-14'-オキサスピロ[オキソラン-2,13'-テトラシクロ[9.3.2.01,10.02,7]ヘキサデカン]-2',4',6'-トリエン-3-オール
  • (1'R,2S,3R,4S,10'R,11'R,12'S)-5'-methoxy-4,5,5,6',10',12'-hexamethyl-14'-oxaspiro[oxolane-2,13'-tetracyclo[9.3.2.01,10.02,7]hexadecane]-2',4',6'-trien-3-ol
Other name (3)：
  • (2S)-3′β,4α,4′aα,5,5,7′-Hexamethyl-8′-methoxy-4′β,10′bβ-ethano-3′,4′,4′a,5′,6′,10′b-hexahydrospiro[oxolane-2,2′-[2H]naphtho[1,2-b]pyran]-3α-ol
  • ブラゼイスピロールC
  • Blazeispirol C
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