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SARASINOSIDE_R
SpectraBase Compound ID L6klh4t8SBf
InChI InChI=1S/C62H100N2O28/c1-25(2)18-29(70)19-26(3)30-10-14-59(8)31(30)11-16-62(82)60(9)15-13-38(58(6,7)37(60)12-17-61(59,62)81)90-57-51(45(75)36(24-84-57)89-53-39(63-27(4)68)46(76)41(71)32(20-65)85-53)91-54-40(64-28(5)69)47(77)44(74)35(88-54)23-83-56-52(49(79)43(73)34(22-67)87-56)92-55-50(80)48(78)42(72)33(21-66)86-55/h11,18,26,30,32-57,65-67,71-82H,10,12-17,19-24H2,1-9H3,(H,63,68)(H,64,69)/t26-,30-,32-,33-,34-,35-,36-,37+,38+,39-,40-,41+,42-,43-,44-,45+,46-,47-,48+,49+,50-,51-,52-,53+,54+,55+,56-,57+,59+,60+,61+,62+/m1/s1
InChIKey JZASRPOFXGPITI-BOLCQSASSA-N
Mol Weight 1321.5 g/mol
Molecular Formula C62H100N2O28
Exact Mass 1320.646261 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8JH3ZdvApKw
Name SARASINOSIDE_R
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C62H100N2O28
InChI InChI=1S/C62H100N2O28/c1-25(2)18-29(70)19-26(3)30-10-14-59(8)31(30)11-16-62(82)60(9)15-13-38(58(6,7)37(60)12-17-61(59,62)81)90-57-51(45(75)36(24-84-57)89-53-39(63-27(4)68)46(76)41(71)32(20-65)85-53)91-54-40(64-28(5)69)47(77)44(74)35(88-54)23-83-56-52(49(79)43(73)34(22-67)87-56)92-55-50(80)48(78)42(72)33(21-66)86-55/h11,18,26,30,32-57,65-67,71-82H,10,12-17,19-24H2,1-9H3,(H,63,68)(H,64,69)/t26-,30-,32-,33-,34-,35-,36-,37+,38+,39-,40-,41+,42-,43-,44-,45+,46-,47-,48+,49+,50-,51-,52-,53+,54+,55+,56-,57+,59+,60+,61+,62+/m1/s1
InChIKey JZASRPOFXGPITI-BOLCQSASSA-N
Literature Reference Author J.H.LEEMJ.JEON,Y.J.LEE,H.S.LEE,C.J.SIM,K.B.OH,J.SHIN
Literature Reference Citation J.NAT.PROD.,75,1365(2012)
Literature Reference DOI 10.1021/np300297d
Molecular Weight 1321.473 g/mol
Sample ID 41317
Solvent CD3OD