| SpectraBase Compound ID | 8CN20w9BpGQ |
|---|---|
| InChI | InChI=1S/C29H44O4/c1-18-8-13-29(24(32)33)15-14-27(4)19(20(29)16-18)6-7-22-25(2)11-10-23(31)26(3,17-30)21(25)9-12-28(22,27)5/h6,20-23,30-31H,1,7-17H2,2-5H3,(H,32,33)/t20-,21+,22+,23-,25-,26-,27+,28+,29-/m0/s1 |
| InChIKey | FKUBIEWSGBVADJ-VZBPFLCRSA-N |
| Mol Weight | 456.7 g/mol |
| Molecular Formula | C29H44O4 |
| Exact Mass | 456.32396 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DfCynS85EMm |
|---|---|
| Name | 30-NORHEDERAGENIN |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H44O4 |
| InChI | InChI=1S/C29H44O4/c1-18-8-13-29(24(32)33)15-14-27(4)19(20(29)16-18)6-7-22-25(2)11-10-23(31)26(3,17-30)21(25)9-12-28(22,27)5/h6,20-23,30-31H,1,7-17H2,2-5H3,(H,32,33)/t20-,21+,22+,23-,25-,26-,27+,28+,29-/m0/s1 |
| InChIKey | FKUBIEWSGBVADJ-VZBPFLCRSA-N |
| Literature Reference Author | K.POELLMANN,K.SCHALLER,U.SCHWEIZER,M.H.A.ELGAMAL,K.H.SHAKER, K.SEIFERT |
| Literature Reference Citation | PHYTOCHEM.,48,875(1998) |
| Literature Reference DOI | 10.1016/S0031-9422(97)00981-3 |
| Molecular Weight | 456.666 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS1262 |