Chem
J-GLOBAL ID：200907002092902598
Nikkaji number：J1.990.248J
3,3′,3aα,3′aβ,5,5′,11bα,11′bβ-Octahydro-7,7′-dimethoxy-5β,5′β-dimethyl-5,5′-dihydroxy-9,9′-bi[2H-furo[3,2-b]naphtho[2,3-d]pyran]-2,2′,6,6′,11,11′-hexone
3,3′,3aα,3′aβ,5,5′,11bα,11′bβ-オクタヒドロ-7,7′-ジメトキシ-5β,5′β-ジメチル-5,5′-ジヒドロキシ-9,9′-ビ[2H-フロ[3,2-b]ナフト[2,3-d]ピラン]-2,2′,6,6′,11,11′-ヘキサオン
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： C34H26O14
Molecular formula furigana： C34-H26-O14
Molecular weight： 658.568
InChI：
InChI=1S/C34H26O14/c1-33(41)25-23(31-17(47-33)9-19(35)45-31)27(37)13-5-11(7-15(43-3)21(13)29(25)39)12-6-14-22(16(8-12)44-4)30(40)26-24(28(14)38)32-18(10-20(36)46-32)48-34(26,2)42/h5-8,17-18,31-32,41-42H,9-10H2,1-4H3/t17-,18+,31+,32-,33-,34-/m0/s1
InChI key：
NMAUJOKJAPSPNA-OPSVDMNHSA-N
SMILES：
COc1cc(cc2C(=O)C3=C(C(=O)c12)[C@@](C)(O)O[C@@H]1CC(=O)O[C@H]31)c1cc(OC)c2C(=O)C3=C([C@@H]4OC(=O)C[C@@H]4O[C@]3(C)O)C(=O)c2c1
Systematic name (3)：
- 3,3′,3aα,3′aβ,5,5′,11bα,11′bβ-オクタヒドロ-7,7′-ジメトキシ-5β,5′β-ジメチル-5,5′-ジヒドロキシ-9,9′-ビ[2H-フロ[3,2-b]ナフト[2,3-d]ピラン]-2,2′,6,6′,11,11′-ヘキサオン
- (11R,15R,17S)-17-ヒドロキシ-6-[(11S,15S,17S)-17-ヒドロキシ-4-メトキシ-17-メチル-2,9,13-トリオキソ-12,16-ジオキサテトラシクロ[8.7.0.03,8.011,15]ヘプタデカ-1(10),3,5,7-テトラエン-6-イル]-4-メトキシ-17-メチル-12,16-ジオキサテトラシクロ[8.7.0.03,8.011,15]ヘプタデカ-1(10),3(8),4,6-テトラエン-2,9,13-トリオン
- (11R,15R,17S)-17-hydroxy-6-[(11S,15S,17S)-17-hydroxy-4-methoxy-17-methyl-2,9,13-trioxo-12,16-dioxatetracyclo[8.7.0.03,8.011,15]heptadeca-1(10),3,5,7-tetraen-6-yl]-4-methoxy-17-methyl-12,16-dioxatetracyclo[8.7.0.03,8.011,15]heptadeca-1(10),3(8),4,6-tetraene-2,9,13-trione
- 3,3′,3aα,3′aβ,5,5′,11bα,11′bβ-Octahydro-7,7′-dimethoxy-5β,5′β-dimethyl-5,5′-dihydroxy-9,9′-bi[2H-furo[3,2-b]naphtho[2,3-d]pyran]-2,2′,6,6′,11,11′-hexone
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