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NOVAEGUINOSIDE_C;SODIUM-(20-R,24-S)-6-ALPHA-O-[3-O-METHYL-BETA-D-QUINOVOPYRANOSYL-(1->2)-BETA-D-XYLOPYRANOSYL-(1->3)-BETA-D-GLUCOPYRANOSYL]-
SpectraBase Compound ID IOrnCgNxs9n
InChI InChI=1S/C45H76O22S2.2Na/c1-20(2)30(67-69(56,57)58)11-8-21(3)25-9-10-26-24-17-31(28-16-23(66-68(53,54)55)12-14-45(28,6)27(24)13-15-44(25,26)5)62-42-37(52)39(35(50)32(18-46)63-42)64-43-40(34(49)29(47)19-60-43)65-41-36(51)38(59-7)33(48)22(4)61-41;;/h13,20-26,28-43,46-52H,8-12,14-19H2,1-7H3,(H,53,54,55)(H,56,57,58);;/q;2*+1/p-2/t21-,22+,23+,24+,25-,26+,28-,29+,30+,31+,32+,33+,34-,35+,36+,37+,38-,39-,40+,41-,42+,43-,44-,45-;;/m1../s1
InChIKey OTPOZQNAEOHAGL-JRZIFHGESA-L
Mol Weight 1077.16453856 g/mol
Molecular Formula C45H74Na2O22S2
Exact Mass 1076.390855 g/mol
Parent InChIKey RIKWFWRFRKOUPP-APJWKABUSA-L
Enantiomer InChIKey OTPOZQNAEOHAGL-HYJCTAMNSA-L
Unknown Identification

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