| SpectraBase Compound ID | IIAKMcddvwb |
|---|---|
| InChI | InChI=1S/C30H46O7/c1-16-9-12-30(24(35)36)14-13-26(3)17(21(30)29(16,6)37)7-8-19-25(2)15-18(31)22(32)28(5,23(33)34)20(25)10-11-27(19,26)4/h7,16,18-22,31-32,37H,8-15H2,1-6H3,(H,33,34)(H,35,36)/t16?,18-,19+,20+,21-,22+,25+,26+,27+,28+,29-,30+/m1/s1 |
| InChIKey | FYGSMJAMPMZYFS-YLIFHPIXSA-N |
| Mol Weight | 518.7 g/mol |
| Molecular Formula | C30H46O7 |
| Exact Mass | 518.324354 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HXAsKMalLml |
|---|---|
| Name | 2-ALPHA,3-BETA,19-ALPHA-TRIHYDROXYOLEAN-12-ENE-23,28-DIOIC-ACID |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H46O7 |
| InChI | InChI=1S/C30H46O7/c1-16-9-12-30(24(35)36)14-13-26(3)17(21(30)29(16,6)37)7-8-19-25(2)15-18(31)22(32)28(5,23(33)34)20(25)10-11-27(19,26)4/h7,16,18-22,31-32,37H,8-15H2,1-6H3,(H,33,34)(H,35,36)/t16?,18-,19+,20+,21-,22+,25+,26+,27+,28+,29-,30+/m1/s1 |
| InChIKey | FYGSMJAMPMZYFS-YLIFHPIXSA-N |
| Literature Reference Author | B.G.WANG,Z.J.JIA |
| Literature Reference Citation | PHYTOCHEM.,49,185(1998) |
| Literature Reference DOI | 10.1016/S0031-9422(97)01057-1 |
| Molecular Weight | 518.691 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU61 |