Chem
J-GLOBAL ID:200907095298375231
Nikkaji number:J755.863E
Davidiol D
ダビジオールD
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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:
C70 H54 O15
Molecular formula furigana:
C70-H54-O15
Molecular weight:
1135.187
InChI:
InChI=1S/C70H54O15/c71-41-12-1-34(2-13-41)3-22-52-63(56(83)33-58-65(52)61(39-23-46(76)27-47(77)24-39)69(85-58)37-8-18-44(74)19-9-37)59(35-4-14-42(72)15-5-35)67-53-29-50(80)31-55(82)64(53)60(36-6-16-43(73)17-7-36)68(67)54-30-51(81)32-57-66(54)62(40-25-48(78)28-49(79)26-40)70(84-57)38-10-20-45(75)21-11-38/h1-33,59-62,67-83H/b22-3+
InChI key:
ABADVAVBDDNCRT-HEQWTUPCSA-N
SMILES:
Oc1ccc(/C=C/c2c3C(C(Oc3cc(O)c2C(C2C(C(c3c2cc(O)cc3O)c2ccc(O)cc2)c2cc(O)cc3OC(C(c23)c2cc(O)cc(O)c2)c2ccc(O)cc2)c2ccc(O)cc2)c2ccc(O)cc2)c2cc(O)cc(O)c2)cc1
Systematic name (3):
2-(4-ヒドロキシフェニル)-3-(3,5-ジヒドロキシフェニル)-4-[(E)-4-ヒドロキシスチリル]-5-[[2-[2-(4-ヒドロキシフェニル)-3-(3,5-ジヒドロキシフェニル)-6-ヒドロキシクマラン-4-イル]-3-(4-ヒドロキシフェニル)-4,6-ジヒドロキシインダン-1-イル](4-ヒドロキシフェニル)メチル]クマラン-6-オール
2-[3-(3,5-ジヒドロキシフェニル)-6-ヒドロキシ-2-(4-ヒドロキシフェニル)-2,3-ジヒドロ-1-ベンゾフラン-4-イル]-1-{[3-(3,5-ジヒドロキシフェニル)-6-ヒドロキシ-2-(4-ヒドロキシフェニル)-4-[(1E)-2-(4-ヒドロキシフェニル)エテニル]-2,3-ジヒドロ-1-ベンゾフラン-5-イル](4-ヒドロキシフェニル)メチル}-3-(4-ヒドロキシフェニル)-2,3-ジヒドロ-1H-インデン-4,6-ジオール
2-[3-(3,5-dihydroxyphenyl)-6-hydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-1-benzofuran-4-yl]-1-{[3-(3,5-dihydroxyphenyl)-6-hydroxy-2-(4-hydroxyphenyl)-4-[(1E)-2-(4-hydroxyphenyl)ethenyl]-2,3-dihydro-1-benzofuran-5-yl](4-hydroxyphenyl)methyl}-3-(4-hydroxyphenyl)-2,3-dihydro-1H-indene-4,6-diol
Other name (3):
ダビジオールD
Davidiol D
2-(4-Hydroxyphenyl)-3-(3,5-dihydroxyphenyl)-4-[(E)-4-hydroxystyryl]-5-[[2-[2-(4-hydroxyphenyl)-3-(3,5-dihydroxyphenyl)-6-hydroxycoumaran-4-yl]-3-(4-hydroxyphenyl)-4,6-dihydroxyindan-1-yl](4-hydroxyphenyl)methyl]coumaran-6-ol
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