| SpectraBase Compound ID | G4CZ3ZwNh9g |
|---|---|
| InChI | InChI=1S/C25H32Cl2N2O8S2/c1-12-15(8-7-9-25(6,26)27)35-21(32)13-10-38-18(28-13)16(30)24(4,5)37-22(33)14-11-39-19(29-14)17(23(2,3)34)36-20(12)31/h10-12,15-17,30,34H,7-9H2,1-6H3/t12-,15-,16+,17+/m0/s1 |
| InChIKey | VZEAHVQDYHOSRG-KKBVYLPWSA-N |
| Mol Weight | 623.6 g/mol |
| Molecular Formula | C25H32Cl2N2O8S2 |
| Exact Mass | 622.097714 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3dEOYSCV5cz |
|---|---|
| Name | DEACETYL-HECTOCHLORIN |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H32Cl2N2O8S2 |
| InChI | InChI=1S/C25H32Cl2N2O8S2/c1-12-15(8-7-9-25(6,26)27)35-21(32)13-10-38-18(28-13)16(30)24(4,5)37-22(33)14-11-39-19(29-14)17(23(2,3)34)36-20(12)31/h10-12,15-17,30,34H,7-9H2,1-6H3/t12-,15-,16+,17+/m0/s1 |
| InChIKey | VZEAHVQDYHOSRG-KKBVYLPWSA-N |
| Literature Reference Author | S.SUNTORNCHASHWEJ,N.CHAICHIT,M.ISOBE,K.SUWANBORIRUX |
| Literature Reference Citation | J.NAT.PROD.,68,951(2005) |
| Literature Reference DOI | 10.1021/np0500124 |
| Molecular Weight | 623.564 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ10477 |