| SpectraBase Compound ID | 9WCvXDEnAuj |
|---|---|
| InChI | InChI=1S/C46H80O12/c1-8-33-15-12-10-11-13-17-37(49)30(4)38(50)25-35(55-7)26-39(51)31(5)45(54)34(9-2)19-21-44(53)56-43-28-46(57-41(20-18-33)36(43)16-14-24-47)23-22-29(3)42(58-46)27-40(52)32(6)48/h10-12,15,19,21,29-43,45,47-52,54H,8-9,13-14,16-18,20,22-28H2,1-7H3/b11-10+,15-12+,21-19+ |
| InChIKey | FLYKWDUJFCRUET-VRIAYSOYSA-N |
| Mol Weight | 825.1 g/mol |
| Molecular Formula | C46H80O12 |
| Exact Mass | 824.564978 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FRCkSIQuwGP |
|---|---|
| Name | MACLAFUNGIN |
| Compound Number | 10 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C46H80O12 |
| InChI | InChI=1S/C46H80O12/c1-8-33-15-12-10-11-13-17-37(49)30(4)38(50)25-35(55-7)26-39(51)31(5)45(54)34(9-2)19-21-44(53)56-43-28-46(57-41(20-18-33)36(43)16-14-24-47)23-22-29(3)42(58-46)27-40(52)32(6)48/h10-12,15,19,21,29-43,45,47-52,54H,8-9,13-14,16-18,20,22-28H2,1-7H3/b11-10+,15-12+,21-19+ |
| InChIKey | FLYKWDUJFCRUET-VRIAYSOYSA-N |
| Literature Reference Author | S.SATO,F.IWATA,S.YAMADA,M.KATAYAMA |
| Literature Reference Citation | J.NAT.PROD.,75,1974(2012) |
| Literature Reference DOI | 10.1021/np300719g |
| Molecular Weight | 825.134 g/mol |
| Sample ID | 41632 |
| Solvent | CDCl3 |