| SpectraBase Compound ID | LDStj3GbKDX |
|---|---|
| InChI | InChI=1S/C27H44O6/c1-15-24(30)22(29)14-23(32-15)33-16(2)27(31)12-9-21-19-6-5-17-13-18(28)7-10-25(17,3)20(19)8-11-26(21,27)4/h5,15-16,18-24,28-31H,6-14H2,1-4H3/t15-,16?,18-,19+,20-,21-,22+,23+,24+,25-,26-,27-/m0/s1 |
| InChIKey | MQSVACYEBUOKAY-BYNQRNFUSA-N |
| Mol Weight | 464.6 g/mol |
| Molecular Formula | C27H44O6 |
| Exact Mass | 464.313789 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 2jnDF3xZIAk |
|---|---|
| Name | DELTA(5)-PREGNENE-3-BETA,17-ALPHA,20(S)-TRIOL-20-O-BETA-D-CANAROSIDE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H44O6 |
| InChI | InChI=1S/C27H44O6/c1-15-24(30)22(29)14-23(32-15)33-16(2)27(31)12-9-21-19-6-5-17-13-18(28)7-10-25(17,3)20(19)8-11-26(21,27)4/h5,15-16,18-24,28-31H,6-14H2,1-4H3/t15-,16?,18-,19+,20-,21-,22+,23+,24+,25-,26-,27-/m0/s1 |
| InChIKey | MQSVACYEBUOKAY-BYNQRNFUSA-N |
| Literature Reference Author | H.ITOKAWA,J.XU,K.TAKEYA |
| Literature Reference Citation | CHEM.PHARM.BULL.,36,2084(1988) |
| Literature Reference DOI | 10.1248/cpb.36.2084 |
| Molecular Weight | 464.643 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWBK1237 |