| SpectraBase Compound ID | 4uuxZ22htLe |
|---|---|
| InChI | InChI=1S/C46H78N2O15/c1-13-35(50)60-34-24-36(51)56-27(3)17-15-14-16-18-33(61-37-20-19-32(47(8)9)28(4)57-37)26(2)23-31(21-22-49)42(43(34)55-12)63-45-40(52)39(48(10)11)41(29(5)59-45)62-38-25-46(7,54)44(53)30(6)58-38/h14-16,18,22,26-34,37-45,52-54H,13,17,19-21,23-25H2,1-12H3/b15-14+,18-16+/t26?,27?,28-,29+,30-,31?,32+,33?,34?,37?,38+,39+,40+,41-,42?,43?,44?,45-,46?/m1/s1 |
| InChIKey | HSZLKTCKAYXVBX-IIKKWEDPSA-N |
| Mol Weight | 899.1 g/mol |
| Molecular Formula | C46H78N2O15 |
| Exact Mass | 898.54022 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GdSoioszRp3 |
|---|---|
| Name | Spiramycin iii |
| CAS Registry Number | 24916-52-7 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C46H78N2O15 |
| InChI | InChI=1S/C46H78N2O15/c1-13-35(50)60-34-24-36(51)56-27(3)17-15-14-16-18-33(61-37-20-19-32(47(8)9)28(4)57-37)26(2)23-31(21-22-49)42(43(34)55-12)63-45-40(52)39(48(10)11)41(29(5)59-45)62-38-25-46(7,54)44(53)30(6)58-38/h14-16,18,22,26-34,37-45,52-54H,13,17,19-21,23-25H2,1-12H3/b15-14+,18-16+/t26?,27?,28-,29+,30-,31?,32+,33?,34?,37?,38+,39+,40+,41-,42?,43?,44?,45-,46?/m1/s1 |
| InChIKey | HSZLKTCKAYXVBX-IIKKWEDPSA-N |
| Instrument Name | Bruker HX-90 |
| Literature Reference | S. Omura, A. Nakagawa, A. Neszmelyi, J. Am. Chem. Soc. 97, 4001 (1975). |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |