Chem
J-GLOBAL ID：200907014460390800   Nikkaji number：J1.697.350E

(3R,4R)-3,4-Bis(3-methoxyphenyl)hexanedioic acid bis[(1R,4R)-3α-(diphenylmethyl)-1,7,7-trimethylbicyclo[2.2.1]heptane-2α-yl] ester

(3R,4R)-3,4-ビス(3-メトキシフェニル)ヘキサン二酸ビス[(1R,4R)-3α-(ジフェニルメチル)-1,7,7-トリメチルビシクロ[2.2.1]ヘプタン-2α-イル]
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： C66H74O6
Molecular formula furigana： C66-H74-O6
Molecular weight： 963.312
InChI： InChI=1S/C66H74O6/c1-63(2)53-35-37-65(63,5)61(59(53)57(43-23-13-9-14-24-43)44-25-15-10-16-26-44)71-55(67)41-51(47-31-21-33-49(39-47)69-7)52(48-32-22-34-50(40-48)70-8)42-56(68)72-62-60(54-36-38-66(62,6)64(54,3)4)58(45-27-17-11-18-28-45)46-29-19-12-20-30-46/h9-34,39-40,51-54,57-62H,35-38,41-42H2,1-8H3/t51-,52-,53+,54+,59-,60-,61+,62+,65-,66-/m0/s1
InChI key： DYXZJIJVBHKGHQ-XKTXXJACSA-N
SMILES： COc1cccc(c1)[C@H](CC(=O)O[C@@H]1[C@H](C(c2ccccc2)c2ccccc2)[C@H]2CC[C@]1(C)C2(C)C)[C@@H](CC(=O)O[C@@H]1[C@H](C(c2ccccc2)c2ccccc2)[C@H]2CC[C@]1(C)C2(C)C)c1cccc(OC)c1
Systematic name  (3)：
  • (3R,4R)-3,4-ビス(3-メトキシフェニル)ヘキサン二酸ビス[(1R,4R)-3α-(ジフェニルメチル)-1,7,7-トリメチルビシクロ[2.2.1]ヘプタン-2α-イル]
  • ビス[(1R,2R,3S,4R)-3-(ジフェニルメチル)-1,7,7-トリメチルビシクロ[2.2.1]ヘプタン-2-イル] (3R,4R)-3,4-ビス(3-メトキシフェニル)ヘキサンジオアート
  • bis[(1R,2R,3S,4R)-3-(diphenylmethyl)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-yl] (3R,4R)-3,4-bis(3-methoxyphenyl)hexanedioate
Other name (1)：
  • (3R,4R)-3,4-Bis(3-methoxyphenyl)hexanedioic acid bis[(1R,4R)-3α-(diphenylmethyl)-1,7,7-trimethylbicyclo[2.2.1]heptane-2α-yl] ester
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