Chem
J-GLOBAL ID:200907074076542728   Nikkaji number:J148.879A

Diterpenoid EF-D

ジテルペノイドEF-D
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: C27H38O7
Molecular formula furigana: C27-H38-O7
Molecular weight: 474.594
InChI: InChI=1S/C27H38O7/c1-8-14(2)23(30)34-26-11-16(4)27(32)19(21(26)24(26,6)7)10-18(13-33-17(5)28)12-25(31)20(27)9-15(3)22(25)29/h9-10,14,16,19-21,31-32H,8,11-13H2,1-7H3/t14?,16-,19+,20-,21-,25-,26+,27-/m1/s1
InChI key: QOSLYAARSBMQOF-NBJLYKDOSA-N
SMILES: CCC(C)C(=O)O[C@@]12C[C@@H](C)[C@]3(O)[C@@H]4C=C(C)C(=O)[C@@]4(O)CC(=C[C@H]3[C@@H]1C2(C)C)COC(=O)C
Systematic name  (4):
  • (1aR)-3-(アセチルオキシメチル)-1,1aα,1bβ,4,4a,7aα,7b,8,9,9a-デカヒドロ-4aβ,7bα-ジヒドロキシ-1,1,6,8α-テトラメチル-9aα-(α-メチルブチリルオキシ)-5H-シクロプロパ[3,4]ベンゾ[1,2-e]アズレン-5-オン
  • 2-メチルブタン酸1,1aα,1bβ,4,4a,5,7aα,7b,8,9-デカヒドロ-4aβ,7bα-ジヒドロキシ-3-(アセトキシメチル)-1,1,6,8α-テトラメチル-5-オキソ-9aH-シクロプロパ[3,4]ベンゾ[1,2-e]アズレン-9aα-イル
  • (1R,2S,6R,10S,11R,13S,15R)-8-[(アセチルオキシ)メチル]-1,6-ジヒドロキシ-4,12,12,15-テトラメチル-5-オキソテトラシクロ[8.5.0.02,6.011,13]ペンタデカ-3,8-ジエン-13-イル 2-メチルブタノアート
  • (1R,2S,6R,10S,11R,13S,15R)-8-[(acetyloxy)methyl]-1,6-dihydroxy-4,12,12,15-tetramethyl-5-oxotetracyclo[8.5.0.02,6.011,13]pentadeca-3,8-dien-13-yl 2-methylbutanoate
Other name (8):
  • 12-Desoxyphorbol 13-α-methylbutyrate 20-acetate
  • 12-デオキシホルボール13-α-メチルブチラート20-アセタート
  • (1aR)-3-(Acetyloxymethyl)-1,1aα,1bβ,4,4a,7aα,7b,8,9,9a-decahydro-4aβ,7bα-dihydroxy-1,1,6,8α-tetramethyl-9aα-(α-methylbutyryloxy)-5H-cyclopropa[3,4]benz[1,2-e]azulen-5-one
  • 2-Methylbutanoic acid 1,1aα,1bβ,4,4a,5,7aα,7b,8,9-decahydro-4aβ,7bα-dihydroxy-3-(acetoxymethyl)-1,1,6,8α-tetramethyl-5-oxo-9aH-cyclopropa[3,4]benzo[1,2-e]azulene-9aα-yl ester
  • Diterpenoid EF-D
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CAS registry number: 25090-73-7
KEGG COMPOUND: C09086
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