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(7R,8'R,8''S)-RASHOMONIC-ACID-C
SpectraBase Compound ID 2s5PTFhX1CA
InChI InChI=1S/C36H32O16/c37-23-5-1-17(9-26(23)40)3-8-33(45)51-32(36(49)50)14-20-13-29(43)30(44)15-21(20)22(19-4-7-25(39)28(42)12-19)16-34(46)52-31(35(47)48)11-18-2-6-24(38)27(41)10-18/h1-10,12-13,15,22,31-32,37-44H,11,14,16H2,(H,47,48)(H,49,50)/b8-3+/t22-,31-,32-/m1/s1
InChIKey RTPGOEQPYCTARL-WEMOAIMHSA-N
Mol Weight 720.6 g/mol
Molecular Formula C36H32O16
Exact Mass 720.169035 g/mol
Enantiomer InChIKey RTPGOEQPYCTARL-BHIZQQDASA-N
Unknown Identification

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