| SpectraBase Compound ID | EVqlQkDVC8F |
|---|---|
| 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-VOZVDIHASA-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 | RR0JQIjnim |
|---|---|
| Name | CHALCOMYCIN |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. 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-VOZVDIHASA-N |
| Literature Reference Author | N.MORISAKI,Y.HASHIMOTO,K.FURIHATA,K.YAZAWA,M.TAMURA,Y.MIKAMI |
| Literature Reference Citation | J.ANTIBIOTICS,54,157(2001) |
| Literature Reference DOI | 10.7164/antibiotics.54.157 |
| Molecular Weight | 700.821 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSI1421 |