![CYClO-[(2-HYDROXY-PENTANOIC-ACID)-PIPERIDINOYL-ISOLEUCYL-METHYLVALYL-METHYLALANYL-BETA-ALANYL-];DESTRUXIN-A1](/api/spectrum/4vUsrEPzHXN/structure.png?h=300&w=458 "CYClO-[(2-HYDROXY-PENTANOIC-ACID)-PIPERIDINOYL-ISOLEUCYL-METHYLVALYL-METHYLALANYL-BETA-ALANYL-];DESTRUXIN-A1")
| SpectraBase Compound ID | C9VB2IS1AyJ |
|---|---|
| InChI | InChI=1S/C30H49N5O7/c1-9-13-22-28(39)35-17-12-11-14-21(35)27(38)32-24(19(5)10-2)29(40)34(8)25(18(3)4)30(41)33(7)20(6)26(37)31-16-15-23(36)42-22/h9,18-22,24-25H,1,10-17H2,2-8H3,(H,31,37)(H,32,38)/t19?,20?,21?,22-,24?,25?/m1/s1 |
| InChIKey | VCMDZWFWWFIEOO-UQAXAITPSA-N |
| Mol Weight | 591.8 g/mol |
| Molecular Formula | C30H49N5O7 |
| Exact Mass | 591.363199 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 4vUsrEPzHXN |
|---|---|
| Name | CYClO-[(2-HYDROXY-PENTANOIC-ACID)-PIPERIDINOYL-ISOLEUCYL-METHYLVALYL-METHYLALANYL-BETA-ALANYL-];DESTRUXIN-A1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H49N5O7 |
| InChI | InChI=1S/C30H49N5O7/c1-9-13-22-28(39)35-17-12-11-14-21(35)27(38)32-24(19(5)10-2)29(40)34(8)25(18(3)4)30(41)33(7)20(6)26(37)31-16-15-23(36)42-22/h9,18-22,24-25H,1,10-17H2,2-8H3,(H,31,37)(H,32,38)/t19?,20?,21?,22-,24?,25?/m1/s1 |
| InChIKey | VCMDZWFWWFIEOO-UQAXAITPSA-N |
| Literature Reference Author | A.JEGOROV,P.SEDMERA,V.HAVLICEK,V.MATHA |
| Literature Reference Citation | PHYTOCHEM.,49,1815(1998) |
| Literature Reference DOI | 10.1016/S0031-9422(98)00337-9 |
| Molecular Weight | 591.748 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU724 |