Chem
J-GLOBAL ID:200907025054187516
Nikkaji number:J281.909K
9α,11α-Epoxyfernan
9,11α-エポキシフェルナン
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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:
C30 H50 O
Molecular formula furigana:
C30-H50-O
Molecular weight:
426.729
InChI:
InChI=1S/C30H50O/c1-19(2)20-10-11-22-26(20,5)16-17-27(6)23-13-12-21-25(3,4)14-9-15-28(21,7)30(23)24(31-30)18-29(22,27)8/h19-24H,9-18H2,1-8H3/t20-,21+,22-,23-,24-,26-,27-,28+,29+,30+/m1/s1
InChI key:
IGKBLEWOHNKDGR-KCBMXMAWSA-N
SMILES:
CC(C)[C@H]1CC[C@@H]2[C@]1(C)CC[C@]1(C)[C@H]3CC[C@H]4C(C)(C)CCC[C@]4(C)[C@@]43O[C@@H]4C[C@@]21C
Systematic name (4):
9,11α-エポキシフェルナン
9α,11α-エポキシフェルナン
(1R,3R,5S,6R,9R,10R,13R,14R,17S,22S)-5,10,13,18,18,22-ヘキサメチル-9-(プロパン-2-イル)-2-オキサヘキサシクロ[12.8.0.01,3 .05,13 .06,10 .017,22 ]ドコサン
(1R,3R,5S,6R,9R,10R,13R,14R,17S,22S)-5,10,13,18,18,22-hexamethyl-9-(propan-2-yl)-2-oxahexacyclo[12.8.0.01,3 .05,13 .06,10 .017,22 ]docosane
Other name (1):
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