Chem
J-GLOBAL ID:200907048273565437
Nikkaji number:J15.497K
Vernolepin
ベルノレピン
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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:
C15 H16 O5
Molecular formula furigana:
C15-H16-O5
Molecular weight:
276.288
InChI:
InChI=1S/C15H16O5/c1-4-15-5-9(16)10-7(2)14(18)20-12(10)11(15)8(3)13(17)19-6-15/h4,9-12,16H,1-3,5-6H2/t9-,10+,11+,12-,15+/m0/s1
InChI key:
IFYQXAXVZGMFNW-MVIRXUPPSA-N
SMILES:
O[C@H]1C[C@@]2(COC(=O)C(=C)[C@@H]2[C@H]2OC(=O)C(=C)[C@H]12)C=C
Systematic name (4):
(3aR,9aβ,9bα)-オクタヒドロ-3,9-ジメチレン-4β-ヒドロキシ-5aβ-エテニル-2H-フロ[2,3-f][2]ベンゾピラン-2,8(9H)-ジオン
(3aR,9aβ,9bα)-3a,4,5,5a,6,9,9a,9b-オクタヒドロ-5aβ-ビニル-4β-ヒドロキシ-3,9-ビス(メチレン)-2H-フロ[2,3-f][2]ベンゾピラン-2,8(3H)-ジオン
(1R,2R,6R,7S,9R)-9-エテニル-7-ヒドロキシ-5,13-ジメチリデン-3,11-ジオキサトリシクロ[7.4.0.02,6 ]トリデカン-4,12-ジオン
(1R,2R,6R,7S,9R)-9-ethenyl-7-hydroxy-5,13-dimethylidene-3,11-dioxatricyclo[7.4.0.02,6 ]tridecane-4,12-dione
Other name (5):
ベルノレピン
Vernolepin
(3aR,9aβ,9bα)-3a,4,5,5a,6,9,9a,9b-Octahydro-5aβ-vinyl-4β-hydroxy-3,9-bis(methylene)-2H-furo[2,3-f][2]benzopyran-2,8(3H)-dione
(+)-ベルノレピン
(+)-Vernolepin
CAS registry number:
18542-37-5
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