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#I;DESTOMYCIN-B;5-O-[2,3-O-(6-AMINO-6-DEOXY-L-GLYCERO-D-GLUCO-HEPTOPYRANOSYLIDENE)-BETA-D-MANNOPYRANOSYL]-1,3-DI-(METHYLAMINO)-1,2,3-TRIDEOXY-MYO-INOSITOL
SpectraBase Compound ID ATmKihsDK0B
InChI InChI=1S/C21H39N3O13/c1-23-7-3-8(24-2)11(28)16(10(7)27)34-20-18-17(12(29)9(5-26)33-20)36-21(37-18)19(32)14(31)13(30)15(35-21)6(22)4-25/h6-20,23-32H,3-5,22H2,1-2H3/t6-,7-,8+,9-,10+,11-,12-,13+,14+,15-,16-,17+,18+,19-,20+,21?/m1/s1
InChIKey XQRJFJIKNNEPNI-FCQNOSADSA-N
Mol Weight 541.6 g/mol
Molecular Formula C21H39N3O13
Exact Mass 541.248288 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9lVPCvrNLQQ
Name #I;DESTOMYCIN-B;5-O-[2,3-O-(6-AMINO-6-DEOXY-L-GLYCERO-D-GLUCO-HEPTOPYRANOSYLIDENE)-BETA-D-MANNOPYRANOSYL]-1,3-DI-(METHYLAMINO)-1,2,3-TRIDEOXY-MYO-INOSITOL
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H39N3O13
InChI InChI=1S/C21H39N3O13/c1-23-7-3-8(24-2)11(28)16(10(7)27)34-20-18-17(12(29)9(5-26)33-20)36-21(37-18)19(32)14(31)13(30)15(35-21)6(22)4-25/h6-20,23-32H,3-5,22H2,1-2H3/t6-,7-,8+,9-,10+,11-,12-,13+,14+,15-,16-,17+,18+,19-,20+,21?/m1/s1
InChIKey XQRJFJIKNNEPNI-FCQNOSADSA-N
Literature Reference Author M.SHIMURA,Y.SEKIZAWA,K.IINUMA,H.NAGANAWA,S.KONDO
Literature Reference Citation AGR.BIOL.CHEM.,40,611(1976)
Literature Reference DOI 10.1271/bbb1961.40.611
Molecular Weight 541.553 g/mol
Solvent D2O
Source File Reference UWIR8840