![DIMETHYL-7-[3-BETA-[(6-DEOXY-ALPHA-L-MANNOPYRANOSYL)-OXY]-14-BETA-HYDROXYANDROST-4-EN-17-BETA-YL]-3-OXO-2-AZABICYCLO-[2.2.2]-OCT-5,7-DIENE-5,6-DICARBOXYLATE](/api/spectrum/8VeTT5izSG5/structure.png?h=300&w=458 "DIMETHYL-7-[3-BETA-[(6-DEOXY-ALPHA-L-MANNOPYRANOSYL)-OXY]-14-BETA-HYDROXYANDROST-4-EN-17-BETA-YL]-3-OXO-2-AZABICYCLO-[2.2.2]-OCT-5,7-DIENE-5,6-DICARBOXYLATE")
| SpectraBase Compound ID | 1AZgYez13kE |
|---|---|
| InChI | InChI=1S/C36H49NO11/c1-16-27(38)28(39)29(40)33(47-16)48-18-8-11-34(2)17(14-18)6-7-23-22(34)9-12-35(3)21(10-13-36(23,35)44)19-15-20-24(31(42)45-4)25(32(43)46-5)26(19)37-30(20)41/h14-16,18,20-23,26-29,33,38-40,44H,6-13H2,1-5H3,(H,37,41)/t16-,18-,20+,21+,22-,23+,26-,27-,28+,29+,33+,34-,35+,36-/m0/s1 |
| InChIKey | IMZLKZIZWOINJD-OFFWNYIISA-N |
| Mol Weight | 671.8 g/mol |
| Molecular Formula | C36H49NO11 |
| Exact Mass | 671.330561 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 | 8VeTT5izSG5 |
|---|---|
| Name | DIMETHYL-7-[3-BETA-[(6-DEOXY-ALPHA-L-MANNOPYRANOSYL)-OXY]-14-BETA-HYDROXYANDROST-4-EN-17-BETA-YL]-3-OXO-2-AZABICYCLO-[2.2.2]-OCT-5,7-DIENE-5,6-DICARBOXYLATE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H49NO11 |
| InChI | InChI=1S/C36H49NO11/c1-16-27(38)28(39)29(40)33(47-16)48-18-8-11-34(2)17(14-18)6-7-23-22(34)9-12-35(3)21(10-13-36(23,35)44)19-15-20-24(31(42)45-4)25(32(43)46-5)26(19)37-30(20)41/h14-16,18,20-23,26-29,33,38-40,44H,6-13H2,1-5H3,(H,37,41)/t16-,18-,20+,21+,22-,23+,26-,27-,28+,29+,33+,34-,35+,36-/m0/s1 |
| InChIKey | IMZLKZIZWOINJD-OFFWNYIISA-N |
| Literature Reference Author | J.MORI,S.I.NAGAI,J.SAKAKIBARA,K.TAKEYA,Y.HOTTA |
| Literature Reference Citation | CHEM.PHARM.BULL.,36,48(1988) |
| Literature Reference DOI | 10.1248/cpb.36.48 |
| Molecular Weight | 671.785 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWBK1318 |