Chem
J-GLOBAL ID：200907098003495060
Nikkaji number：J2.638.550D
(2S,7S)-2α-Isopropyl-5α,9-diprenyl-6-methyl-6β-(4-methyl-3-pentenyl)-7α-(2-methylpropionyl)-3a,7-(oxomethylene)-2,3,3aα,4,5,6-hexahydrocycloocta[b]furan-8(7H)-one
(2S,7S)-2α-イソプロピル-5α,9-ジプレニル-6-メチル-6β-(4-メチル-3-ペンテニル)-7α-(2-メチルプロピオニル)-3a,7-(オキソメチレン)-2,3,3aα,4,5,6-ヘキサヒドロシクロオクタ[b]フラン-8(7H)-オン
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
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
Molecular formula： C35H52O4
Molecular formula furigana： C35-H52-O4
Molecular weight： 536.797
InChI：
InChI=1S/C35H52O4/c1-21(2)13-12-18-33(11)26(16-14-22(3)4)19-34-20-28(24(7)8)39-31(34)27(17-15-23(5)6)30(37)35(33,32(34)38)29(36)25(9)10/h13-15,24-26,28H,12,16-20H2,1-11H3/t26-,28-,33+,34-,35+/m0/s1
InChI key：
SXBJMKUNZKJXKD-DZBUENRMSA-N
SMILES：
CC(C)[C@@H]1C[C@@]23C[C@H](CC=C(C)C)[C@@](C)(CCC=C(C)C)[C@](C(=O)C(C)C)(C(=O)C(=C2O1)CC=C(C)C)C3=O
Systematic name (3)：
- (2S,7S)-2α-イソプロピル-5α,9-ジプレニル-6-メチル-6β-(4-メチル-3-ペンテニル)-7α-(2-メチルプロピオニル)-3a,7-(オキソメチレン)-2,3,3aα,4,5,6-ヘキサヒドロシクロオクタ[b]フラン-8(7H)-オン
- (1S,3S,8S,9R,10S)-9-メチル-6,10-ビス(3-メチルブタ-2-エン-1-イル)-9-(4-メチルペンタ-3-エン-1-イル)-8-(2-メチルプロパノイル)-3-(プロパン-2-イル)-4-オキサトリシクロ[6.3.1.01,5]ドデカ-5-エン-7,12-ジオン
- (1S,3S,8S,9R,10S)-9-methyl-6,10-bis(3-methylbut-2-en-1-yl)-9-(4-methylpent-3-en-1-yl)-8-(2-methylpropanoyl)-3-(propan-2-yl)-4-oxatricyclo[6.3.1.01,5]dodec-5-ene-7,12-dione
- (2S,7S)-2α-Isopropyl-5α,9-diprenyl-6-methyl-6β-(4-methyl-3-pentenyl)-7α-(2-methylpropionyl)-3a,7-(oxomethylene)-2,3,3aα,4,5,6-hexahydrocycloocta[b]furan-8(7H)-one
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