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NEORUSCOGENIN-1-O-[O-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-3-O-ACETYL-4-O-[(2S,3S)-2-HYDROXY-3-METHYLPENTANOYL]-ALPHA-L-ARABINOPYRANOSIDE]
SpectraBase Compound ID 4xxOKiLhSnN
InChI InChI=1S/C46H70O15/c1-9-22(3)35(49)41(53)58-32-20-54-43(40(39(32)57-25(6)47)60-42-38(52)37(51)36(50)24(5)56-42)59-33-17-27(48)16-26-10-11-28-29(45(26,33)8)13-14-44(7)30(28)18-31-34(44)23(4)46(61-31)15-12-21(2)19-55-46/h10,22-24,27-40,42-43,48-52H,2,9,11-20H2,1,3-8H3/t22-,23-,24+,27+,28+,29-,30-,31-,32+,33+,34-,35-,36+,37-,38-,39+,40-,42+,43+,44-,45-,46+/m0/s1
InChIKey GWYMUKPJMPPUTG-DDJKXHOJSA-N
Mol Weight 863.1 g/mol
Molecular Formula C46H70O15
Exact Mass 862.471472 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KJqeMD2uqiS
Name NEORUSCOGENIN-1-O-[O-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-3-O-ACETYL-4-O-[(2S,3S)-2-HYDROXY-3-METHYLPENTANOYL]-ALPHA-L-ARABINOPYRANOSIDE]
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C46H70O15
InChI InChI=1S/C46H70O15/c1-9-22(3)35(49)41(53)58-32-20-54-43(40(39(32)57-25(6)47)60-42-38(52)37(51)36(50)24(5)56-42)59-33-17-27(48)16-26-10-11-28-29(45(26,33)8)13-14-44(7)30(28)18-31-34(44)23(4)46(61-31)15-12-21(2)19-55-46/h10,22-24,27-40,42-43,48-52H,2,9,11-20H2,1,3-8H3/t22-,23-,24+,27+,28+,29-,30-,31-,32+,33+,34-,35-,36+,37-,38-,39+,40-,42+,43+,44-,45-,46+/m0/s1
InChIKey GWYMUKPJMPPUTG-DDJKXHOJSA-N
Literature Reference Author Y.MIMAKI,M.KURODA,A.KAMEYAMA,A.YOKOSUKA,Y.SASHIDA
Literature Reference Citation CHEM.PHARM.BULL.,46,298(1998)
Literature Reference DOI 10.1248/cpb.46.298
Molecular Weight 863.053 g/mol
Solvent C5D5N
Source File Reference UWMS6231