Chem
J-GLOBAL ID：200907047458001274
Nikkaji number：J629.159G
Heliannuol D
ヘリアンヌオールD
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
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
Molecular formula： C15H22O3
Molecular formula furigana： C15-H22-O3
Molecular weight： 250.338
InChI：
InChI=1S/C15H22O3/c1-9-5-6-14(15(3,4)17)18-13-7-10(2)12(16)8-11(9)13/h7-9,14,16-17H,5-6H2,1-4H3/t9-,14-/m0/s1
InChI key：
BIIJJHXLFCDTIZ-XPTSAGLGSA-N
SMILES：
C[C@H]1CC[C@H](Oc2cc(C)c(O)cc12)C(C)(C)O
Systematic name (5)：
- (2S,5S)-2,3,4,5-テトラヒドロ-5,8-ジメチル-2-(1-ヒドロキシ-1-メチルエチル)-1-ベンゾオキセピン-7-オール
- 2α-(1-ヒドロキシ-1-メチルエチル)-5α,8-ジメチル-2,3,4,5-テトラヒドロ-1-ベンゾオキセピン-7-オール
- (2S)-α,α,5α,8-テトラメチル-7-ヒドロキシ-2,3,4,5-テトラヒドロ-1-ベンゾオキセピン-2α-メタノール
- (2S,5S)-2-(2-ヒドロキシプロパン-2-イル)-5,8-ジメチル-2,3,4,5-テトラヒドロ-1-ベンゾオキセピン-7-オール
- (2S,5S)-2-(2-hydroxypropan-2-yl)-5,8-dimethyl-2,3,4,5-tetrahydro-1-benzoxepin-7-ol
- ヘリアンヌオールD
- Heliannuol D
- (2S,5S)-2,3,4,5-Tetrahydro-5,8-dimethyl-2-(1-hydroxy-1-methylethyl)-1-benzoxepin-7-ol
- 2α-(1-Hydroxy-1-methylethyl)-5α,8-dimethyl-2,3,4,5-tetrahydro-1-benzoxepin-7-ol
- (2S)-α,α,5α,8-Tetramethyl-7-hydroxy-2,3,4,5-tetrahydro-1-benzoxepin-2α-methanol
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