| SpectraBase Compound ID | y4x2pPGApb |
|---|---|
| InChI | InChI=1S/C29H44O7/c1-5-18-7-9-22-21-8-6-19-14-20(10-13-29(19,15-30)23(21)11-12-28(18,22)4)36-27-26(35-17(3)31)25(33)24(32)16(2)34-27/h5,15-16,18-27,32-33H,1,6-14H2,2-4H3/t16-,18-,19-,20-,21-,22-,23-,24+,25+,26-,27-,28+,29+/m0/s1 |
| InChIKey | UMIRLEUKTVXFPA-MTZLFJCPSA-N |
| Mol Weight | 504.7 g/mol |
| Molecular Formula | C29H44O7 |
| Exact Mass | 504.308704 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3LKVhMhElvt |
|---|---|
| Name | SCLEROSTEROID-N;3-BETA-(2'-O-ACETYL-ALPHA-L-FUCOPYRANOSYLOXY)-5-ALPHA-PREGNA-20-EN-19-AL |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H44O7 |
| InChI | InChI=1S/C29H44O7/c1-5-18-7-9-22-21-8-6-19-14-20(10-13-29(19,15-30)23(21)11-12-28(18,22)4)36-27-26(35-17(3)31)25(33)24(32)16(2)34-27/h5,15-16,18-27,32-33H,1,6-14H2,2-4H3/t16-,18-,19-,20-,21-,22-,23-,24+,25+,26-,27-,28+,29+/m0/s1 |
| InChIKey | UMIRLEUKTVXFPA-MTZLFJCPSA-N |
| Literature Reference Author | H.Y.FANG,C.H.HSU,C.H.CHAO,Z.H.WEN,Y.C.WU,C.F.DAI,J.H.SHEU |
| Literature Reference Citation | MAR.DRUGS,11,1853(2013) |
| Literature Reference DOI | 10.3390/md11061853 |
| Molecular Weight | 504.664 g/mol |
| Source File Reference | UWLU74859 |