Chem
J-GLOBAL ID:200907051619250935   Nikkaji number:J514.541D

4,4a,5,6,7,8,8aβ,9-Octahydro-6β-hydroxy-4β-[(E)-2-methyl-2-butenoyloxy]-3,4aβ,5β-trimethylnaphtho[2,3-b]furan-2(9aβH)-one

4,4a,5,6,7,8,8aβ,9-オクタヒドロ-6β-ヒドロキシ-4β-[(E)-2-メチル-2-ブテノイルオキシ]-3,4aβ,5β-トリメチルナフト[2,3-b]フラン-2(9aβH)-オン
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: C20H28O5
Molecular formula furigana: C20-H28-O5
Molecular weight: 348.439
InChI: InChI=1S/C20H28O5/c1-6-10(2)18(22)25-17-16-11(3)19(23)24-15(16)9-13-7-8-14(21)12(4)20(13,17)5/h6,12-15,17,21H,7-9H2,1-5H3/b10-6+/t12-,13+,14-,15-,17+,20+/m0/s1
InChI key: VHVVIDFLXPOQAK-UKKIBBPISA-N
SMILES: C/C=C(\C)/C(=O)O[C@@H]1C2=C(C)C(=O)O[C@H]2C[C@H]2CC[C@H](O)[C@H](C)[C@@]12C
Systematic name  (3):
  • 4,4a,5,6,7,8,8aβ,9-オクタヒドロ-6β-ヒドロキシ-4β-[(E)-2-メチル-2-ブテノイルオキシ]-3,4aβ,5β-トリメチルナフト[2,3-b]フラン-2(9aβH)-オン
  • (4S,4aS,5R,6S,8aR,9aS)-6-ヒドロキシ-3,4a,5-トリメチル-2-オキソ-2H,4H,4aH,5H,6H,7H,8H,8aH,9H,9aH-ナフト[2,3-b]フラン-4-イル (2E)-2-メチルブタ-2-エノアート
  • (4S,4aS,5R,6S,8aR,9aS)-6-hydroxy-3,4a,5-trimethyl-2-oxo-2H,4H,4aH,5H,6H,7H,8H,8aH,9H,9aH-naphtho[2,3-b]furan-4-yl (2E)-2-methylbut-2-enoate
Other name (1):
  • 4,4a,5,6,7,8,8aβ,9-Octahydro-6β-hydroxy-4β-[(E)-2-methyl-2-butenoyloxy]-3,4aβ,5β-trimethylnaphtho[2,3-b]furan-2(9aβH)-one
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