Chem
J-GLOBAL ID：200907080428588111   Nikkaji number：J1.010.716D

5,6:24(S),25-Diepoxycholesterol

5,6:24(S),25-ジエポキシコレステロール
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： C27H44O3
Molecular formula furigana： C27-H44-O3
Molecular weight： 416.646
InChI： InChI=1S/C27H44O3/c1-16(6-9-22-24(2,3)29-22)19-7-8-20-18-14-23-27(30-23)15-17(28)10-13-26(27,5)21(18)11-12-25(19,20)4/h16-23,28H,6-15H2,1-5H3/t16-,17+,18+,19-,20+,21+,22+,23+,25-,26-,27+/m1/s1
InChI key： IUSLCYDEWITGFD-AISCQZDLSA-N
SMILES： C[C@H](CC[C@@H]1OC1(C)C)[C@H]1CC[C@H]2[C@@H]3C[C@@H]4O[C@]54C[C@@H](O)CC[C@]5(C)[C@H]3CC[C@]12C
Systematic name  (3)：
  • (24S)-5,6α:24,25-ジエポキシ-5α-コレスタン-3β-オール
  • (1S,2R,5S,7R,9S,11S,12S,15R,16R)-15-[(2R)-4-[(2S)-3,3-ジメチルオキシラン-2-イル]ブタン-2-イル]-2,16-ジメチル-8-オキサペンタシクロ[9.7.0.02,7.07,9.012,16]オクタデカン-5-オール
  • (1S,2R,5S,7R,9S,11S,12S,15R,16R)-15-[(2R)-4-[(2S)-3,3-dimethyloxiran-2-yl]butan-2-yl]-2,16-dimethyl-8-oxapentacyclo[9.7.0.02,7.07,9.012,16]octadecan-5-ol
Other name (5)：
  • (24S)-5,6α:24,25-Diepoxy-5α-cholestane-3β-ol
  • 5,6:24(S),25-Diepoxycholesterol
  • 5,6:24(S),25-ジエポキシコレステロール
  • (24S,25)-エポキシコレステロールα-エポキシド
  • (24S,25)-Epoxycholesterol α-epoxide
CAS registry number： 220066-69-3
KEGG COMPOUND： C15633
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