Chem
J-GLOBAL ID:200907070949218234
Nikkaji number:J1.697.353J
(3R,4R)-3,4-Bis(2-naphthyl)hexanedioic acid bis[(1R,4R)-3α-(diphenylmethyl)-1,7,7-trimethylbicyclo[2.2.1]heptane-2α-yl] ester
(3R,4R)-3,4-ビス(2-ナフチル)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]
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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:
C72 H74 O4
Molecular formula furigana:
C72-H74-O4
Molecular weight:
1003.380
InChI:
InChI=1S/C72H74O4/c1-69(2)59-39-41-71(69,5)67(65(59)63(49-25-11-7-12-26-49)50-27-13-8-14-28-50)75-61(73)45-57(55-37-35-47-23-19-21-33-53(47)43-55)58(56-38-36-48-24-20-22-34-54(48)44-56)46-62(74)76-68-66(60-40-42-72(68,6)70(60,3)4)64(51-29-15-9-16-30-51)52-31-17-10-18-32-52/h7-38,43-44,57-60,63-68H,39-42,45-46H2,1-6H3/t57-,58-,59+,60+,65-,66-,67+,68+,71-,72-/m0/s1
InChI key:
CMOKCFQQQUTRLS-WGVYHORASA-N
SMILES:
CC1(C)[C@@H]2CC[C@@]1(C)[C@H](OC(=O)C[C@H]([C@@H](CC(=O)O[C@@H]1[C@H](C(c3ccccc3)c3ccccc3)[C@H]3CC[C@]1(C)C3(C)C)c1ccc3ccccc3c1)c1ccc3ccccc3c1)[C@@H]2C(c1ccccc1)c1ccccc1
Systematic name (3):
(3R,4R)-3,4-ビス(2-ナフチル)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(ナフタレン-2-イル)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(naphthalen-2-yl)hexanedioate
Other name (1):
(3R,4R)-3,4-Bis(2-naphthyl)hexanedioic acid bis[(1R,4R)-3α-(diphenylmethyl)-1,7,7-trimethylbicyclo[2.2.1]heptane-2α-yl] ester
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