| SpectraBase Compound ID | ANbJaidIyb6 |
|---|---|
| InChI | InChI=1S/C35H56O14/c1-17-10-13-26(37)46-20(4)22(16-44-34-32(43-9)31(42-8)27(38)21(5)47-34)30-23(48-30)11-12-25(36)35(6,40)15-18(2)29(17)49-33-28(39)24(41-7)14-19(3)45-33/h10-13,17-24,27-34,38-40H,14-16H2,1-9H3/b12-11+,13-10+/t17?,18?,19-,20?,21+,22?,23?,24-,27+,28-,29?,30?,31+,32+,33-,34-,35?/m0/s1 |
| InChIKey | KLGADJPDTCIJLO-KMCNZSPMSA-N |
| Mol Weight | 700.8 g/mol |
| Molecular Formula | C35H56O14 |
| Exact Mass | 700.367006 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | K3DNqfRZrQf |
|---|---|
| Name | Chalcomycin |
| CAS Registry Number | 20283-48-1 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C35H56O14 |
| InChI | InChI=1S/C35H56O14/c1-17-10-13-26(37)46-20(4)22(16-44-34-32(43-9)31(42-8)27(38)21(5)47-34)30-23(48-30)11-12-25(36)35(6,40)15-18(2)29(17)49-33-28(39)24(41-7)14-19(3)45-33/h10-13,17-24,27-34,38-40H,14-16H2,1-9H3/b12-11+,13-10+/t17?,18?,19-,20?,21+,22?,23?,24-,27+,28-,29?,30?,31+,32+,33-,34-,35?/m0/s1 |
| InChIKey | KLGADJPDTCIJLO-KMCNZSPMSA-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 |