Chem
J-GLOBAL ID：200907017042412651   Nikkaji number：J1.316.501G

1α,2β-[(R)-2-(2-O,3-O,4-O-Triethyl-α-L-rhamnopyranosyloxy)propane-1,3-diyl]-8β-ethyl-12α-[[5α-(dimethylamino)-6β-methyltetrahydro-2H-pyran]-2β-yloxy]-13β-methyl-1,2,4aα,4bβ,8,9,10,11,12,13-decahydro-7-oxa-7H-cyclododeca[a]indene-6,14(5H,15aαH)-dione

(1R,17R)-8β-エチル-12α-[5α-(ジメチルアミノ)-6β-メチルテトラヒドロ-2H-ピラン-2β-イルオキシ]-13β-メチル-17-(2-O,3-O,4-O-トリエチル-α-L-ラムノピラノシルオキシ)-1α,2β-プロパノ-1,2,4aα,4bβ,5,6,8,9,10,11,12,13,14,15aα-テトラデカヒドロ-7-オキサ-7H-シクロドデカ[a]インデン-6,14-ジオン
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： C44H71NO10
Molecular formula furigana： C44-H71-N-O10
Molecular weight： 774.049
InChI： InChI=1S/C44H71NO10/c1-10-29-15-14-16-37(55-39-20-19-36(45(8)9)26(6)51-39)25(5)40(47)35-23-33-31(34(35)24-38(46)53-29)18-17-28-21-30(22-32(28)33)54-44-43(50-13-4)42(49-12-3)41(48-11-2)27(7)52-44/h17-18,23,25-34,36-37,39,41-44H,10-16,19-22,24H2,1-9H3/t25-,26-,27+,28-,29+,30-,31-,32-,33-,34+,36+,37+,39+,41+,42-,43-,44+/m1/s1
InChI key： PKLCMEXQNQVPAG-BRMYKJQNSA-N
SMILES： CCO[C@H]1[C@H](C)O[C@@H](O[C@@H]2C[C@H]3C=C[C@H]4[C@@H]5CC(=O)O[C@@H](CC)CCC[C@H](O[C@H]6CC[C@@H]([C@@H](C)O6)N(C)C)[C@@H](C)C(=O)C5=C[C@H]4[C@@H]3C2)[C@H](OCC)[C@@H]1OCC
Systematic name  (5)：
  • (1R,17R)-8β-エチル-12α-[5α-(ジメチルアミノ)-6β-メチルテトラヒドロ-2H-ピラン-2β-イルオキシ]-13β-メチル-17-(2-O,3-O,4-O-トリエチル-α-L-ラムノピラノシルオキシ)-1α,2β-プロパノ-1,2,4aα,4bβ,5,6,8,9,10,11,12,13,14,15aα-テトラデカヒドロ-7-オキサ-7H-シクロドデカ[a]インデン-6,14-ジオン
  • 1α,2β-[(R)-2-(2-O,3-O,4-O-トリエチル-α-L-ラムノピラノシルオキシ)プロパン-1,3-ジイル]-8β-エチル-12α-[[5α-(ジメチルアミノ)-6β-メチルテトラヒドロ-2H-ピラン]-2β-イルオキシ]-13β-メチル-1,2,4aα,4bβ,5,6,8,9,10,11,12,13,14,15aα-テトラデカヒドロ-7-オキサ-7H-シクロドデカ[a]インデン-6,14-ジオン
  • 1α,2β-[(R)-2-(2-O,3-O,4-O-トリエチル-α-L-ラムノピラノシルオキシ)プロパン-1,3-ジイル]-8β-エチル-12α-[[5α-(ジメチルアミノ)-6β-メチルテトラヒドロ-2H-ピラン]-2β-イルオキシ]-13β-メチル-1,2,4aα,4bβ,8,9,10,11,12,13-デカヒドロ-7-オキサ-7H-シクロドデカ[a]インデン-6,14(5H,15aαH)-ジオン
  • (2R,3aS,5aR,5bS,9S,13S,14R,16aS,16bR)-13-{[(2R,5S,6R)-5-(ジメチルアミノ)-6-メチルオキサン-2-イル]オキシ}-9-エチル-14-メチル-2-{[(2R,3R,4R,5S,6S)-3,4,5-トリエトキシ-6-メチルオキサン-2-イル]オキシ}-1H,2H,3H,3aH,5aH,5bH,6H,7H,9H,10H,11H,12H,13H,14H,15H,16aH,16bH-as-インダセノ[3,2-d]オキサシクロドデカン-7,15-ジオン
  • (2R,3aS,5aR,5bS,9S,13S,14R,16aS,16bR)-13-{[(2R,5S,6R)-5-(dimethylamino)-6-methyloxan-2-yl]oxy}-9-ethyl-14-methyl-2-{[(2R,3R,4R,5S,6S)-3,4,5-triethoxy-6-methyloxan-2-yl]oxy}-1H,2H,3H,3aH,5aH,5bH,6H,7H,9H,10H,11H,12H,13H,14H,15H,16aH,16bH-as-indaceno[3,2-d]oxacyclododecane-7,15-dione
Other name (3)：
  • (1R,17R)-8β-Ethyl-12α-[5α-(dimethylamino)-6β-methyltetrahydro-2H-pyran-2β-yloxy]-13β-methyl-17-(2-O,3-O,4-O-triethyl-α-L-rhamnopyranosyloxy)-1α,2β-propano-1,2,4aα,4bβ,5,6,8,9,10,11,12,13,14,15aα-tetradecahydro-7-oxa-7H-cyclododeca[a]indene-6,14-dione
  • 1α,2β-[(R)-2-(2-O,3-O,4-O-Triethyl-α-L-rhamnopyranosyloxy)propane-1,3-diyl]-8β-ethyl-12α-[[5α-(dimethylamino)-6β-methyltetrahydro-2H-pyran]-2β-yloxy]-13β-methyl-1,2,4aα,4bβ,5,6,8,9,10,11,12,13,14,15aα-tetradecahydro-7-oxa-7H-cyclododeca[a]indene-6,14-dione
  • 1α,2β-[(R)-2-(2-O,3-O,4-O-Triethyl-α-L-rhamnopyranosyloxy)propane-1,3-diyl]-8β-ethyl-12α-[[5α-(dimethylamino)-6β-methyltetrahydro-2H-pyran]-2β-yloxy]-13β-methyl-1,2,4aα,4bβ,8,9,10,11,12,13-decahydro-7-oxa-7H-cyclododeca[a]indene-6,14(5H,15aαH)-dione
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