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ASPERELINE_A
SpectraBase Compound ID ILA6bgnXAYm
InChI InChI=1S/C45H80N10O11/c1-19-25(4)30(48-35(62)40(7,8)51-32(59)29(24(2)3)47-36(63)42(11,12)53-37(64)43(13,14)49-27(6)57)33(60)52-44(15,16)38(65)54-41(9,10)34(61)46-26(5)31(58)50-45(17,18)39(66)55-22-20-21-28(55)23-56/h24-26,28-30,56H,19-23H2,1-18H3,(H,46,61)(H,47,63)(H,48,62)(H,49,57)(H,50,58)(H,51,59)(H,52,60)(H,53,64)(H,54,65)/t25?,26-,28-,29-,30-/m0/s1
InChIKey TYDXSTUVLGPNBK-LFGLAULDSA-N
Mol Weight 937.2 g/mol
Molecular Formula C45H80N10O11
Exact Mass 936.600803 g/mol
Enantiomer InChIKey TYDXSTUVLGPNBK-QJLMFMSLSA-N
Unknown Identification

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