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BELLISSAPONIN BS4
SpectraBase Compound ID 8CcEbdvUW2l
InChI InChI=1S/C54H88O24/c1-21-31(59)35(63)40(68)45(72-21)76-42-38(66)34(62)27(20-71-44-39(67)36(64)32(60)25(18-55)73-44)75-47(42)78-48(70)54-14-13-49(2,3)15-23(54)22-9-10-29-51(6)16-24(57)43(77-46-41(69)37(65)33(61)26(19-56)74-46)50(4,5)28(51)11-12-52(29,7)53(22,8)17-30(54)58/h9,21,23-47,55-69H,10-20H2,1-8H3/t21-,23?,24-,25+,26+,27+,28?,29?,30+,31-,32+,33+,34+,35+,36-,37-,38-,39+,40+,41+,42+,43-,44+,45+,46-,47-,51-,52+,53+,54+/m1/s1
InChIKey KFCMOOGMXQYLSR-FFJMGVFESA-N
Mol Weight 1121.3 g/mol
Molecular Formula C54H88O24
Exact Mass 1120.566554 g/mol
Enantiomer InChIKey KFCMOOGMXQYLSR-MJNHWSOQSA-N
Unknown Identification

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