Chem
J-GLOBAL ID：200907013591516064
Nikkaji number：J1.149.711J
6,7,8,9-Tetrahydro-2-methoxy-3-isopropyl-8-[3-[2-(hydroxymethyl)oxirane-2-yl]propyl]-5H-benzocycloheptene
6,7,8,9-テトラヒドロ-2-メトキシ-3-イソプロピル-8-[3-[2-(ヒドロキシメチル)オキシラン-2-イル]プロピル]-5H-ベンゾシクロヘプテン
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： C21H32O3
Molecular formula furigana： C21-H32-O3
Molecular weight： 332.484
InChI：
InChI=1S/C21H32O3/c1-15(2)19-11-17-8-4-6-16(10-18(17)12-20(19)23-3)7-5-9-21(13-22)14-24-21/h11-12,15-16,22H,4-10,13-14H2,1-3H3
InChI key：
GXBBGUURQXDBGS-UHFFFAOYSA-N
SMILES：
COc1cc2CC(CCCC3(CO)CO3)CCCc2cc1C(C)C
Systematic name (3)：
- 6,7,8,9-テトラヒドロ-2-メトキシ-3-イソプロピル-8-[3-[2-(ヒドロキシメチル)オキシラン-2-イル]プロピル]-5H-ベンゾシクロヘプテン
- (2-{3-[3-メトキシ-2-(プロパン-2-イル)-6,7,8,9-テトラヒドロ-5H-ベンゾ[7]アンヌレン-6-イル]プロピル}オキシラン-2-イル)メタノール
- (2-{3-[3-methoxy-2-(propan-2-yl)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-yl]propyl}oxiran-2-yl)methanol
- 6,7,8,9-Tetrahydro-2-methoxy-3-isopropyl-8-[3-[2-(hydroxymethyl)oxirane-2-yl]propyl]-5H-benzocycloheptene
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