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2-[(7-ALPHA-O-10-METHYL-7-ISOALLOXAZINO)-METHYL]-BETA-CYCLODEXTRIN
SpectraBase Compound ID Kl4zL81qP2q
InChI InChI=1S/C54H78N4O37/c1-58-15-3-2-13(4-14(15)55-23-45(58)56-54(80)57-46(23)79)12-81-44-36(78)43-22(11-65)88-53(44)95-42-21(10-64)87-51(35(77)29(42)71)93-40-19(8-62)85-49(33(75)27(40)69)91-38-17(6-60)83-47(31(73)25(38)67)89-37-16(5-59)82-48(30(72)24(37)66)90-39-18(7-61)84-50(32(74)26(39)68)92-41-20(9-63)86-52(94-43)34(76)28(41)70/h2-4,16-22,24-44,47-53,59-78H,5-12H2,1H3,(H,57,79,80)/t16-,17+,18-,19-,20-,21-,22+,24-,25+,26-,27-,28-,29-,30-,31+,32-,33-,34-,35-,36-,37-,38+,39-,40-,41-,42-,43+,44+,47+,48-,49-,50-,51-,52-,53+/m0/s1
InChIKey BZHOLWFWJGMJAF-CZQUDNMBSA-N
Mol Weight 1375.2 g/mol
Molecular Formula C54H78N4O37
Exact Mass 1374.434489 g/mol
Enantiomer InChIKey BZHOLWFWJGMJAF-NMMSDNDQSA-N
Unknown Identification

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