| SpectraBase Compound ID | Ipk1W03dljV |
|---|---|
| InChI | InChI=1S/C29H42IN3O6/c1-16(2)26-29(38)39-20(6)12-18(4)10-17(3)11-19(5)27(36)31-15-25(35)33(7)23(28(37)32-26)14-21-8-9-24(34)22(30)13-21/h8-10,13,16,18-20,23,26,34H,11-12,14-15H2,1-7H3,(H,31,36)(H,32,37)/b17-10-/t18-,19-,20-,23+,26-/m0/s1 |
| InChIKey | HADLOGUIGHOPEZ-DCHGYYRWSA-N |
| Mol Weight | 655.6 g/mol |
| Molecular Formula | C29H42IN3O6 |
| Exact Mass | 655.211831 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5yxDgzxXvqk |
|---|---|
| Name | NEOSIPHOLIAMONIDE-A |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H42IN3O6 |
| InChI | InChI=1S/C29H42IN3O6/c1-16(2)26-29(38)39-20(6)12-18(4)10-17(3)11-19(5)27(36)31-15-25(35)33(7)23(28(37)32-26)14-21-8-9-24(34)22(30)13-21/h8-10,13,16,18-20,23,26,34H,11-12,14-15H2,1-7H3,(H,31,36)(H,32,37)/b17-10-/t18-,19-,20-,23+,26-/m0/s1 |
| InChIKey | HADLOGUIGHOPEZ-DCHGYYRWSA-N |
| Literature Reference Author | M.V.D'AURIA,L.G.PALOMA,L.MINALE,A.ZAMPELLA,C.DEBITUS,J.PEREZ |
| Literature Reference Citation | J.NAT.PROD.,58,121(1995) |
| Literature Reference DOI | 10.1021/np50115a017 |
| Molecular Weight | 655.573 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVP72 |