| SpectraBase Compound ID | 9d78trRux2H |
|---|---|
| InChI | InChI=1S/C34H34N4O4/c1-8-19-15(3)22-12-24-17(5)21-10-11-28(39)33(40)30(31(21)37-24)32-29(34(41)42-7)18(6)25(38-32)14-27-20(9-2)16(4)23(36-27)13-26(19)35-22/h8,12-14,17,21,35,38H,1,9-11H2,2-7H3/b22-12-,23-13-,24-12-,25-14-,26-13-,27-14-,32-30+/t17-,21-/m0/s1 |
| InChIKey | UXURCYOUDGVCOE-YAHNLHHCSA-N |
| Mol Weight | 562.7 g/mol |
| Molecular Formula | C34H34N4O4 |
| Exact Mass | 562.258006 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | vlMDYabxQk |
|---|---|
| Name | CHLOROPHYLLONIC-ACID-A-METHYLESTER |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H34N4O4 |
| InChI | InChI=1S/C34H34N4O4/c1-8-19-15(3)22-12-24-17(5)21-10-11-28(39)33(40)30(31(21)37-24)32-29(34(41)42-7)18(6)25(38-32)14-27-20(9-2)16(4)23(36-27)13-26(19)35-22/h8,12-14,17,21,35,38H,1,9-11H2,2-7H3/b22-12-,23-13-,24-12-,25-14-,26-13-,27-14-,32-30+/t17-,21-/m0/s1 |
| InChIKey | UXURCYOUDGVCOE-YAHNLHHCSA-N |
| Literature Reference Author | N.WATANABE,K.YAMAMOTO,H.IHSHIKAWA,A.YAGI,K.SAKATA,L.S.BRINEN ,J.CLARDY |
| Literature Reference Citation | J.NAT.PROD.,56,305(1993) |
| Literature Reference DOI | 10.1021/np50093a001 |
| Molecular Weight | 562.668 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWPR2018 |