| SpectraBase Compound ID | G0fN9y8jruM |
|---|---|
| InChI | InChI=1S/C27H42O7/c1-14(33-25-24(32)23(31)22(30)21(13-28)34-25)18-6-7-19-17-5-4-15-12-16(29)8-10-26(15,2)20(17)9-11-27(18,19)3/h12,14,17-25,28,30-32H,4-11,13H2,1-3H3/t14-,17+,18-,19+,20+,21+,22+,23-,24+,25+,26+,27-/m1/s1 |
| InChIKey | CVVSZDAAVMEBAJ-SCQFHSMCSA-N |
| Mol Weight | 478.6 g/mol |
| Molecular Formula | C27H42O7 |
| Exact Mass | 478.293054 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | K5y2LNJDDUI |
|---|---|
| Name | (3-OXO-PREGN-4-EN-20-BETA-YL)-BETA-D-GLUCOPYRANOSIDE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H42O7 |
| InChI | InChI=1S/C27H42O7/c1-14(33-25-24(32)23(31)22(30)21(13-28)34-25)18-6-7-19-17-5-4-15-12-16(29)8-10-26(15,2)20(17)9-11-27(18,19)3/h12,14,17-25,28,30-32H,4-11,13H2,1-3H3/t14-,17+,18-,19+,20+,21+,22+,23-,24+,25+,26+,27-/m1/s1 |
| InChIKey | CVVSZDAAVMEBAJ-SCQFHSMCSA-N |
| Literature Reference Author | S.SEO,Y.TOMITA,K.TORI,Y.YOSHIMURA |
| Literature Reference Citation | J.AM.CHEM.SOC.,100,3331(1978) |
| Literature Reference DOI | 10.1021/ja00479a014 |
| Molecular Weight | 478.626 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWCS10427 |