Chem
J-GLOBAL ID:200907026634256724
Nikkaji number:J2.330.109A
3,3-Dihydroperoxy-5α-cholestane
3,3-ジヒドロペルオキシ-5α-コレスタン
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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:
C27 H48 O4
Molecular formula furigana:
C27-H48-O4
Molecular weight:
436.677
InChI:
InChI=1S/C27H48O4/c1-18(2)7-6-8-19(3)22-11-12-23-21-10-9-20-17-27(30-28,31-29)16-15-25(20,4)24(21)13-14-26(22,23)5/h18-24,28-29H,6-17H2,1-5H3/t19-,20+,21+,22-,23+,24+,25+,26-/m1/s1
InChI key:
NCPHEJHCTIOHDA-FHNVJLOUSA-N
SMILES:
CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4CC(CC[C@]4(C)[C@H]3CC[C@]12C)(OO)OO
Systematic name (4):
3,3-ジヒドロペルオキシ-5α-コレスタン
5α-コレスタン-3,3-ジイルジヒドロペルオキシド
(1R,3aS,3bR,5aS,9aS,9bS,11aR)-9a,11a-ジメチル-1-[(2R)-6-メチルヘプタン-2-イル]-ヘキサデカヒドロ-1H-シクロペンタ[a]フェナントレン-7,7-ジペルオキソール
(1R,3aS,3bR,5aS,9aS,9bS,11aR)-9a,11a-dimethyl-1-[(2R)-6-methylheptan-2-yl]-hexadecahydro-1H-cyclopenta[a]phenanthrene-7,7-diperoxol
Other name (2):
3,3-Dihydroperoxy-5α-cholestane
5α-Cholestane-3,3-diyldihydroperoxide
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