| SpectraBase Spectrum ID |
Hh18uIrhD3l |
| Name |
Destruxin A, 1-[1-(5-chloro-2,4-dihydroxy-1-oxopentyl)-L-proline]- |
| Alternate Name(s) |
Pyrrolo[1,2-d][1,4,7,10,13,16]oxapentaazacyclononadecine, cyclic peptide deriv.
(3S,6S,9S,16R)-16-(3-chloro-2-hydroxypropyl)-6-isopropyl-5,8,9-trimethyl-3-[(1S)-1-methylpropyl]dodecahydropyrrolo[1,2-d][1,4,7,10,13,16]oxapentaazacyclononadecine-1,4,7,10,14,17(11H,16H)-hexone
Chlorohydrin |
| CAS Registry Number |
121723-07-7 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H48ClN5O8 |
| InChI |
InChI=1S/C29H48ClN5O8/c1-8-17(4)23-28(41)34(7)24(16(2)3)29(42)33(6)18(5)25(38)31-12-11-22(37)43-21(14-19(36)15-30)27(40)35-13-9-10-20(35)26(39)32-23/h16-21,23-24,36H,8-15H2,1-7H3,(H,31,38)(H,32,39)/t17?,18-,19?,20?,21+,23-,24-/m0/s1 |
| InChIKey |
WUTLOXOGFQPKLT-NQFMFEGNSA-N |
| Molecular Weight |
630.183 g/mol |
| SMILES |
N1C(C2N(C([C@@](CC(O)CCl)(OC(CCNC([C@@](N(C([C@@](N(C([C@@]1(C(CC)C)[H])=O)C)(C(C)C)[H])=O)C)(C)[H])=O)=O)[H])=O)CCC2)=O |
| SPLASH |
splash10-00kp-0003940000-41edaf1d8a56ac927973 |
| Source of Spectrum |
KC-1989-2356-10 |
| Wiley ID |
1412040 |
![Destruxin A, 1-[1-(5-chloro-2,4-dihydroxy-1-oxopentyl)-L-proline]-](/api/spectrum/Hh18uIrhD3l/structure.png?h=300&w=458 "Destruxin A, 1-[1-(5-chloro-2,4-dihydroxy-1-oxopentyl)-L-proline]-")
