| SpectraBase Compound ID | 87Hxz8y79jr |
|---|---|
| InChI | InChI=1S/C28H46O7/c1-15-22(30)24(33-5)23(31)25(34-15)35-18-8-11-26(3)17(14-18)6-7-19-20(26)9-12-27(4)21(19)10-13-28(27,32)16(2)29/h6,15-16,18-25,29-32H,7-14H2,1-5H3/t15-,16?,18+,19-,20+,21+,22+,23-,24+,25+,26+,27+,28+/m1/s1 |
| InChIKey | YYZQPDQBCGZPBO-INKZLICGSA-N |
| Mol Weight | 494.7 g/mol |
| Molecular Formula | C28H46O7 |
| Exact Mass | 494.324354 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DDNr3tGKYtU |
|---|---|
| Name | DELTA(5)-PREGNENE-3-BETA,17-ALPHA,20(S)-TRIOL-3-O-BETA-D-DIGITALOPYRANOSIDE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H46O7 |
| InChI | InChI=1S/C28H46O7/c1-15-22(30)24(33-5)23(31)25(34-15)35-18-8-11-26(3)17(14-18)6-7-19-20(26)9-12-27(4)21(19)10-13-28(27,32)16(2)29/h6,15-16,18-25,29-32H,7-14H2,1-5H3/t15-,16?,18+,19-,20+,21+,22+,23-,24+,25+,26+,27+,28+/m1/s1 |
| InChIKey | YYZQPDQBCGZPBO-INKZLICGSA-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 | 494.669 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWBK1241 |