| SpectraBase Compound ID | 5BKnhkL1mSE |
|---|---|
| InChI | InChI=1S/C31H54N2O11/c1-12-21-31(8)25(43-29(38)44-31)19(6)32-26(36)15(2)14-30(7,39-11)24(17(4)22(34)18(5)27(37)41-21)42-28-23(35)20(33(9)10)13-16(3)40-28/h15-25,28,34-35H,12-14H2,1-11H3,(H,32,36)/t15-,16-,17+,18-,19-,20+,21-,22+,23-,24-,25+,28+,30-,31-/m1/s1 |
| InChIKey | GJRIGBOXCFJRFJ-BZIZHZQDSA-N |
| Mol Weight | 630.8 g/mol |
| Molecular Formula | C31H54N2O11 |
| Exact Mass | 630.372761 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2GsnuajBDWI |
|---|---|
| Name | 6-O-ALLYL-3-O-DECLADINOSYL-9A-AZA-9A-HOMOERYTHROMYCIN_A_11,12-CYCLIC-CARBONATE |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H54N2O11 |
| InChI | InChI=1S/C31H54N2O11/c1-12-21-31(8)25(43-29(38)44-31)19(6)32-26(36)15(2)14-30(7,39-11)24(17(4)22(34)18(5)27(37)41-21)42-28-23(35)20(33(9)10)13-16(3)40-28/h15-25,28,34-35H,12-14H2,1-11H3,(H,32,36)/t15-,16-,17+,18-,19-,20+,21-,22+,23-,24-,25+,28+,30-,31-/m1/s1 |
| InChIKey | GJRIGBOXCFJRFJ-BZIZHZQDSA-N |
| Literature Reference Author | S.ALIHODZIC,A.FAJDETIC,G.KOBREHEL,G.LAZAREVSKI,S.MUTAK,D.PAV LOVIC,V.STIMAC,H.CIP |
| Literature Reference Citation | J.ANTIBIOTICS,59,753(2006) |
| Literature Reference DOI | 10.1038/ja.2006.100 |
| Molecular Weight | 630.777 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMB489 |