| SpectraBase Compound ID | JbYjSCoZOxX |
|---|---|
| InChI | InChI=1S/C25H29NO7/c1-13-11-25-9-6-19(29)24(2,18(25)10-15(13)17(28)12-25)8-7-20(30)26-21-16(27)5-4-14(22(21)31)23(32)33-3/h4-6,9,15,17-18,27-28,31H,1,7-8,10-12H2,2-3H3,(H,26,30)/t15-,17+,18-,24-,25+/m0/s1 |
| InChIKey | AWKBYGDVFUXVBB-DBEHWDQHSA-N |
| Mol Weight | 455.51 g/mol |
| Molecular Formula | C25H29NO7 |
| Exact Mass | 455.194402 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2ZFnxouGj1v |
|---|---|
| Name | PLATENCIN_A2_METHYLESTER |
| Compound Number | 8D |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H29NO7 |
| InChI | InChI=1S/C25H29NO7/c1-13-11-25-9-6-19(29)24(2,18(25)10-15(13)17(28)12-25)8-7-20(30)26-21-16(27)5-4-14(22(21)31)23(32)33-3/h4-6,9,15,17-18,27-28,31H,1,7-8,10-12H2,2-3H3,(H,26,30)/t15-,17+,18-,24-,25+/m0/s1 |
| InChIKey | AWKBYGDVFUXVBB-DBEHWDQHSA-N |
| Literature Reference Author | C.ZHANG,J.ONDEYKA,K.HERATH,H.JAYASURIYA,Z.GUAN,D.L.ZINK,L.DI ETRICH,B.BURGESS,S.N |
| Literature Reference Citation | J.NAT.PROD.,74,329(2011) |
| Literature Reference DOI | 10.1021/np100635f |
| Molecular Weight | 455.508 g/mol |
| Sample ID | 37424 |
| Solvent | C5D5N |