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METHYL-2-ALPHA,3-BETA,24-TRI-O-ACETYL-URS-12-EN-28-OATE
SpectraBase Compound ID EA42SoA7JlQ
InChI InChI=1S/C37H56O8/c1-21-13-16-37(32(41)42-10)18-17-35(8)26(30(37)22(21)2)11-12-29-33(6)19-27(44-24(4)39)31(45-25(5)40)34(7,20-43-23(3)38)28(33)14-15-36(29,35)9/h11,21-22,27-31H,12-20H2,1-10H3/t21-,22+,27-,28-,29-,30+,31+,33+,34-,35-,36-,37+/m1/s1
InChIKey RBROFYWGBCTLGA-BXEJNOIYSA-N
Mol Weight 628.8 g/mol
Molecular Formula C37H56O8
Exact Mass 628.397519 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IvcfjJZImPF
Name METHYL-2-ALPHA,3-BETA,24-TRI-O-ACETYL-URS-12-EN-28-OATE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H56O8
InChI InChI=1S/C37H56O8/c1-21-13-16-37(32(41)42-10)18-17-35(8)26(30(37)22(21)2)11-12-29-33(6)19-27(44-24(4)39)31(45-25(5)40)34(7,20-43-23(3)38)28(33)14-15-36(29,35)9/h11,21-22,27-31H,12-20H2,1-10H3/t21-,22+,27-,28-,29-,30+,31+,33+,34-,35-,36-,37+/m1/s1
InChIKey RBROFYWGBCTLGA-BXEJNOIYSA-N
Literature Reference Author F.J.Q.MONTE,J.P.KINTZINGER
Literature Reference Citation J.BRAZ.CHEM.SOC.,9,23(1998)
Literature Reference DOI 10.1590/s0103-50531998000100005
Molecular Weight 628.847 g/mol
Solvent CDCl3
Source File Reference UWMS4113