Chem
J-GLOBAL ID:200907000029615969
Nikkaji number:J2.634.632K
(1R)-3α-(Cinnamoyloxy)-4α-(benzoyloxy)-4aβ,8β,10,10-tetramethyl-5β-acetoxy-8aα,2α-(epoxymethano)decahydronaphthalene-1α-ol
(1R)-3α-(シンナモイルオキシ)-4α-(ベンゾイルオキシ)-4aβ,8β,10,10-テトラメチル-5β-アセトキシ-8aα,2α-(エポキシメタノ)デカヒドロナフタレン-1α-オール
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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:
C33 H38 O8
Molecular formula furigana:
C33-H38-O8
Molecular weight:
562.659
InChI:
InChI=1S/C33H38O8/c1-20-16-18-24(38-21(2)34)32(5)29(40-30(37)23-14-10-7-11-15-23)27(26-28(36)33(20,32)41-31(26,3)4)39-25(35)19-17-22-12-8-6-9-13-22/h6-15,17,19-20,24,26-29,36H,16,18H2,1-5H3/b19-17+/t20-,24+,26-,27+,28-,29+,32+,33-/m1/s1
InChI key:
FXJPPIJUTVUQRL-NIQLMDKRSA-N
SMILES:
C[C@@H]1CC[C@H](OC(=O)C)[C@@]2(C)[C@@H](OC(=O)c3ccccc3)[C@@H](OC(=O)/C=C/c3ccccc3)[C@@H]3[C@@H](O)[C@]12OC3(C)C
Systematic name (4):
(1R)-3α-(シンナモイルオキシ)-4α-(ベンゾイルオキシ)-4aβ,8β,10,10-テトラメチル-5β-アセトキシ-8aα,2α-(エポキシメタノ)デカヒドロナフタレン-1α-オール
(10R)-2,2,5aβ,9β-テトラメチル-3,4,5,5a,6,7,8,9-オクタヒドロ-2H-3β,9aβ-メタノ-1-ベンゾオキセピン-4α,5α,6β,10-テトラオール4-[(E)-3-フェニルプロペノアート]5-ベンゾアート6-アセタート
(1S,2R,5S,6S,7R,8S,9S,12R)-5-(アセチルオキシ)-12-ヒドロキシ-2,6,10,10-テトラメチル-8-{[(2E)-3-フェニルプロパ-2-エノイル]オキシ}-11-オキサトリシクロ[7.2.1.01,6 ]ドデカン-7-イル ベンゾアート
(1S,2R,5S,6S,7R,8S,9S,12R)-5-(acetyloxy)-12-hydroxy-2,6,10,10-tetramethyl-8-{[(2E)-3-phenylprop-2-enoyl]oxy}-11-oxatricyclo[7.2.1.01,6 ]dodecan-7-yl benzoate
Other name (2):
(1R)-3α-(Cinnamoyloxy)-4α-(benzoyloxy)-4aβ,8β,10,10-tetramethyl-5β-acetoxy-8aα,2α-(epoxymethano)decahydronaphthalene-1α-ol
(10R)-2,2,5aβ,9β-Tetramethyl-3,4,5,5a,6,7,8,9-octahydro-2H-3β,9aβ-methano-1-benzooxepin-4α,5α,6β,10-tetraol 4-[(E)-3-phenylpropenoate]5-benzoate 6-acetate
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