Chem
J-GLOBAL ID：201007024792134901   Nikkaji number：J2.855.535K

(4aS)-3,4aβ,5β-Trimethyl-6β-(3-methyl-2-butenoyloxy)-9aα-methoxy-2,4,4a,5,6,7,8,8aβ,9,9a-decahydronaphtho[2,3-b]furan-2-one

(4aS)-3,4aβ,5β-トリメチル-6β-(3-メチル-2-ブテノイルオキシ)-9aα-メトキシ-2,4,4a,5,6,7,8,8aβ,9,9a-デカヒドロナフト[2,3-b]フラン-2-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： C21H30O5
Molecular formula furigana： C21-H30-O5
Molecular weight： 362.466
InChI： InChI=1S/C21H30O5/c1-12(2)9-18(22)25-17-8-7-15-10-21(24-6)16(13(3)19(23)26-21)11-20(15,5)14(17)4/h9,14-15,17H,7-8,10-11H2,1-6H3/t14-,15+,17-,20+,21+/m0/s1
InChI key： JRMPASZWXGEACK-HWIQRTGZSA-N
SMILES： CO[C@@]12C[C@H]3CC[C@H](OC(=O)C=C(C)C)[C@H](C)[C@@]3(C)CC1=C(C)C(=O)O2
Systematic name  (3)：
  • (4aS)-3,4aβ,5β-トリメチル-6β-(3-メチル-2-ブテノイルオキシ)-9aα-メトキシ-2,4,4a,5,6,7,8,8aβ,9,9a-デカヒドロナフト[2,3-b]フラン-2-オン
  • (4aS,5R,6S,8aR,9aR)-9a-メトキシ-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-6-イル 3-メチルブタ-2-エノアート
  • (4aS,5R,6S,8aR,9aR)-9a-methoxy-3,4a,5-trimethyl-2-oxo-2H,4H,4aH,5H,6H,7H,8H,8aH,9H,9aH-naphtho[2,3-b]furan-6-yl 3-methylbut-2-enoate
Other name (1)：
  • (4aS)-3,4aβ,5β-Trimethyl-6β-(3-methyl-2-butenoyloxy)-9aα-methoxy-2,4,4a,5,6,7,8,8aβ,9,9a-decahydronaphtho[2,3-b]furan-2-one
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