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BELLERIC-ACID;2-ALPHA,3-BETA,23,24-TETRAHYDROXY-OLEAN-12-EN-28-OIC-ACID
SpectraBase Compound ID DTEExPg4pBB
InChI InChI=1S/C30H48O6/c1-25(2)10-12-29(24(35)36)13-11-27(4)18(19(29)14-25)6-7-21-26(3)15-20(33)23(34)30(16-31,17-32)22(26)8-9-28(21,27)5/h6,19-23,31-34H,7-17H2,1-5H3,(H,35,36)/t19-,20+,21+,22+,23-,26+,27+,28+,29-/m0/s1
InChIKey IHSNIFFMIWMPRL-DCGQWPFASA-N
Mol Weight 504.7 g/mol
Molecular Formula C30H48O6
Exact Mass 504.345089 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FMYAAwQ0Xz1
Name BELLERIC-ACID;2-ALPHA,3-BETA,23,24-TETRAHYDROXY-OLEAN-12-EN-28-OIC-ACID
Compound Number 88
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H48O6
InChI InChI=1S/C30H48O6/c1-25(2)10-12-29(24(35)36)13-11-27(4)18(19(29)14-25)6-7-21-26(3)15-20(33)23(34)30(16-31,17-32)22(26)8-9-28(21,27)5/h6,19-23,31-34H,7-17H2,1-5H3,(H,35,36)/t19-,20+,21+,22+,23-,26+,27+,28+,29-/m0/s1
InChIKey IHSNIFFMIWMPRL-DCGQWPFASA-N
Literature Reference Author S.B.MAHATO,A.P.KUNDU
Literature Reference Citation PHYTOCHEM.,37,1517(1994)
Literature Reference DOI 10.1016/S0031-9422(00)89569-2
Molecular Weight 504.708 g/mol
Solvent CDCl3
Source File Reference UWMS5188