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QUAMOCLIN-VI
SpectraBase Compound ID DDoCqHpZMfZ
InChI InChI=1S/C49H84O24/c1-8-17-26-18-15-13-11-10-12-14-16-19-28(51)68-43-36(59)39(24(6)65-49(43)73-42-32(55)29(52)22(4)62-48(42)66-26)70-47-37(60)41(72-46-34(57)31(54)30(53)27(20-50)67-46)40(25(7)64-47)71-45-35(58)33(56)38(23(5)63-45)69-44(61)21(3)9-2/h21-27,29-43,45-50,52-60H,8-20H2,1-7H3/t21-,22-,23+,24+,25+,26+,27+,29+,30+,31-,32+,33+,34+,35-,36-,37-,38+,39+,40+,41+,42-,43-,45+,46-,47+,48+,49+/m1/s1
InChIKey VWHVRXVZFFVDMC-LNRYSCATSA-N
Mol Weight 1057.2 g/mol
Molecular Formula C49H84O24
Exact Mass 1056.535254 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EQnN1oCBZMC
Name QUAMOCLIN-VI
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C49H84O24
InChI InChI=1S/C49H84O24/c1-8-17-26-18-15-13-11-10-12-14-16-19-28(51)68-43-36(59)39(24(6)65-49(43)73-42-32(55)29(52)22(4)62-48(42)66-26)70-47-37(60)41(72-46-34(57)31(54)30(53)27(20-50)67-46)40(25(7)64-47)71-45-35(58)33(56)38(23(5)63-45)69-44(61)21(3)9-2/h21-27,29-43,45-50,52-60H,8-20H2,1-7H3/t21-,22-,23+,24+,25+,26+,27+,29+,30+,31-,32+,33+,34+,35-,36-,37-,38+,39+,40+,41+,42-,43-,45+,46-,47+,48+,49+/m1/s1
InChIKey VWHVRXVZFFVDMC-LNRYSCATSA-N
Literature Reference Author M.ONO,Y.TAKAKI,M.TAKATSUJI,K.AKIYAMA,M.OKAWA,J.KINJO,H.MIYAS HITA,H.YOSHIMITSU,T.
Literature Reference Citation CHEM.PHARM.BULL.,60,1083(2012)
Literature Reference DOI 10.1248/cpb.c12-00334
Molecular Weight 1057.192 g/mol
Source File Reference UWBT4497