Chem
J-GLOBAL ID:200907034103784338
Nikkaji number:J619.303J
(8E)-8-(6-Heptenylidene)-3α-ethoxy-4,4aβ,5,6,7,8-hexahydro-3H-2-benzopyran
(8E)-8-(6-ヘプテニリデン)-3α-エトキシ-4,4aβ,5,6,7,8-ヘキサヒドロ-3H-2-ベンゾピラン
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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:
C18 H28 O2
Molecular formula furigana:
C18-H28-O2
Molecular weight:
276.420
InChI:
InChI=1S/C18H28O2/c1-3-5-6-7-8-10-15-11-9-12-16-13-18(19-4-2)20-14-17(15)16/h3,10,14,16,18H,1,4-9,11-13H2,2H3/b15-10+/t16-,18-/m0/s1
InChI key:
FMCVDZCYWCTYOX-XVKGOSMNSA-N
SMILES:
CCO[C@@H]1C[C@@H]2CCC/C(=C\CCCCC=C)/C2=CO1
Systematic name (3):
(8E)-8-(6-ヘプテニリデン)-3α-エトキシ-4,4aβ,5,6,7,8-ヘキサヒドロ-3H-2-ベンゾピラン
(3S,4aS,8E)-3-エトキシ-8-(ヘプタ-6-エン-1-イリデン)-4,4a,5,6,7,8-ヘキサヒドロ-3H-2-ベンゾピラン
(3S,4aS,8E)-3-ethoxy-8-(hept-6-en-1-ylidene)-4,4a,5,6,7,8-hexahydro-3H-2-benzopyran
Other name (1):
(8E)-8-(6-Heptenylidene)-3α-ethoxy-4,4aβ,5,6,7,8-hexahydro-3H-2-benzopyran
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