| SpectraBase Compound ID | 9dtEv7E2zFI |
|---|---|
| InChI | InChI=1S/C33H54O8/c1-16-8-11-33(38-15-16)17(2)26-24(41-33)14-23-21-7-6-19-12-20(34)13-25(32(19,5)22(21)9-10-31(23,26)4)40-30-29(37)28(36)27(35)18(3)39-30/h16-30,34-37H,6-15H2,1-5H3/t16-,17+,18-,19+,20-,21-,22+,23+,24+,25-,26+,27+,28+,29-,30+,31+,32+,33-/m1/s1 |
| InChIKey | FYUIDFGRAOPZPR-WGFUVHFZSA-N |
| Mol Weight | 578.8 g/mol |
| Molecular Formula | C33H54O8 |
| Exact Mass | 578.381869 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8N3trZThm7t |
|---|---|
| Name | BRISBAGENIN-FUCOSIDE;1-O-(BETA-L-FUCOPYRANOSYL)-25R,5-ALPHA-SPIROSTANE-1-BETA,3-BETA-DIOL |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H54O8 |
| InChI | InChI=1S/C33H54O8/c1-16-8-11-33(38-15-16)17(2)26-24(41-33)14-23-21-7-6-19-12-20(34)13-25(32(19,5)22(21)9-10-31(23,26)4)40-30-29(37)28(36)27(35)18(3)39-30/h16-30,34-37H,6-15H2,1-5H3/t16-,17+,18-,19+,20-,21-,22+,23+,24+,25-,26+,27+,28+,29-,30+,31+,32+,33-/m1/s1 |
| InChIKey | FYUIDFGRAOPZPR-WGFUVHFZSA-N |
| Literature Reference Author | A.D.PATIL,P.W.BAURES,D.S.EGGLESTONE,L.FAUCETTE,M.E.HEMLING,J .W.WESTLEY,R.K.JOHNS |
| Literature Reference Citation | J.NAT.PROD.,56,1451(1993) |
| Literature Reference DOI | 10.1021/np50099a003 |
| Molecular Weight | 578.787 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWCS17890 |