| SpectraBase Compound ID | LXDqwkSGeer |
|---|---|
| InChI | InChI=1S/C31H48O4/c1-18(2)19(3)9-10-20(27(34)35)26-23(32)17-31(8)22-11-12-24-28(4,5)25(33)14-15-29(24,6)21(22)13-16-30(26,31)7/h11,13,18,20,23-26,32-33H,3,9-10,12,14-17H2,1-2,4-8H3,(H,34,35)/t20?,23-,24+,25-,26+,29-,30-,31+/m1/s1 |
| InChIKey | LADJWZMBZBVBSB-OTCWHLFNSA-N |
| Mol Weight | 484.7 g/mol |
| Molecular Formula | C31H48O4 |
| Exact Mass | 484.35526 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7IyKE08cIOm |
|---|---|
| Name | 3-EPIDEHYDROTUMULOSIC_ACID |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H48O4 |
| InChI | InChI=1S/C31H48O4/c1-18(2)19(3)9-10-20(27(34)35)26-23(32)17-31(8)22-11-12-24-28(4,5)25(33)14-15-29(24,6)21(22)13-16-30(26,31)7/h11,13,18,20,23-26,32-33H,3,9-10,12,14-17H2,1-2,4-8H3,(H,34,35)/t20?,23-,24+,25-,26+,29-,30-,31+/m1/s1 |
| InChIKey | LADJWZMBZBVBSB-OTCWHLFNSA-N |
| Literature Reference Author | T.TAI,T.SHINGU,T.KIKUCHI,Y.TEZUKA,A.AKAHORI |
| Literature Reference Citation | PHYTOCHEM.,39,1165(1995) |
| Literature Reference DOI | 10.1016/0031-9422(95)00110-S |
| Molecular Weight | 484.720 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMZ7787 |