| SpectraBase Compound ID | 6h5VwwXSfDR |
|---|---|
| InChI | InChI=1S/C30H48O6/c1-25(2)11-13-30(24(35)36)14-12-28(5)17(21(30)23(25)34)7-8-20-26(3)15-18(32)22(33)27(4,16-31)19(26)9-10-29(20,28)6/h7,18-23,31-34H,8-16H2,1-6H3,(H,35,36)/t18-,19-,20-,21-,22+,23-,26+,27+,28-,29-,30+/m1/s1 |
| InChIKey | IFIQVSCCFRXSJV-GCVAJSGBSA-N |
| Mol Weight | 504.7 g/mol |
| Molecular Formula | C30H48O6 |
| Exact Mass | 504.345089 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IWDAWAnw6Pd |
|---|---|
| Name | TOMENTOSIC-ACID;2-ALPHA,3-BETA,19-BETA,23-TETRAHYDROXY-OLEAN-12-EN-28-OIC-ACID |
| Compound Number | 85 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H48O6 |
| InChI | InChI=1S/C30H48O6/c1-25(2)11-13-30(24(35)36)14-12-28(5)17(21(30)23(25)34)7-8-20-26(3)15-18(32)22(33)27(4,16-31)19(26)9-10-29(20,28)6/h7,18-23,31-34H,8-16H2,1-6H3,(H,35,36)/t18-,19-,20-,21-,22+,23-,26+,27+,28-,29-,30+/m1/s1 |
| InChIKey | IFIQVSCCFRXSJV-GCVAJSGBSA-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 | C5D5N |
| Source File Reference | UWMS5185 |