| SpectraBase Compound ID | LbNHsMnX2va |
|---|---|
| InChI | InChI=1S/C25H29NO7/c1-13-14-6-10-25(22(13)31)11-7-18(28)24(2,17(25)12-14)9-8-19(29)26-20-16(27)5-4-15(21(20)30)23(32)33-3/h4-5,7,11,14,17,22,27,30-31H,1,6,8-10,12H2,2-3H3,(H,26,29)/t14-,17-,22-,24-,25-/m0/s1 |
| InChIKey | BFEICNQOVVWVIP-CDVZQOEQSA-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 | 6ICSh5zo3XK |
|---|---|
| Name | PLATENCIN_A3_METHYLESTER |
| Compound Number | 8F |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H29NO7 |
| InChI | InChI=1S/C25H29NO7/c1-13-14-6-10-25(22(13)31)11-7-18(28)24(2,17(25)12-14)9-8-19(29)26-20-16(27)5-4-15(21(20)30)23(32)33-3/h4-5,7,11,14,17,22,27,30-31H,1,6,8-10,12H2,2-3H3,(H,26,29)/t14-,17-,22-,24-,25-/m0/s1 |
| InChIKey | BFEICNQOVVWVIP-CDVZQOEQSA-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 | 37425 |
| Solvent | CD3OD |