| SpectraBase Spectrum ID |
IPsuQ97BKru |
| Name |
9-[3-(4-hydroxyphenyl)propyl]-12-isopropyl-3-methyl-6-methylene-1-oxa-4,7,10-triazacyclododecane-2,5,8,11-diquinone |
| Alternate Name(s) |
9-[3-(4-hydroxyphenyl)propyl]-12-isopropyl-3-methyl-6-methylene-1-oxa-4,7,10-triazacyclododecane-2,5,8,11-tetrone
9-[3-(4-hydroxyphenyl)propyl]-3-methyl-6-methylene-12-propan-2-yl-1-oxa-4,7,10-triazacyclododecane-2,5,8,11-tetrone
9-[3-(4-hydroxyphenyl)propyl]-3-methyl-6-methylidene-12-propan-2-yl-1-oxa-4,7,10-triazacyclododecane-2,5,8,11-tetrone
Am toxin III
L-alanine, N-(2,3-didehydro-N-(N-(2-hydroxy-3-methyl-1-oxobutyl)-5-(4-hydroxyphenyl)-L-norvalyl)alanyl)-, kappa-lactone, (S)- |
| CAS Registry Number |
57765-94-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H29N3O6 |
| InChI |
InChI=1S/C22H29N3O6/c1-12(2)18-21(29)25-17(7-5-6-15-8-10-16(26)11-9-15)20(28)23-13(3)19(27)24-14(4)22(30)31-18/h8-12,14,17-18,26H,3,5-7H2,1-2,4H3,(H,23,28)(H,24,27)(H,25,29) |
| InChIKey |
KXURJQNPXSDHDB-UHFFFAOYSA-N |
| Molecular Weight |
431.489 g/mol |
| SMILES |
N1C(CCCc2ccc(cc2)O)C(NC(=C)C(NC(C(OC(C1=O)C(C)C)=O)C)=O)=O |
| SPLASH |
splash10-052f-9810000000-dd67542fd4cbc5c78c5d |
| Source of Spectrum |
KO-4-140-7 |
| Wiley ID |
1381953 |
![9-[3-(4-hydroxyphenyl)propyl]-12-isopropyl-3-methyl-6-methylene-1-oxa-4,7,10-triazacyclododecane-2,5,8,11-diquinone](/api/spectrum/IPsuQ97BKru/structure.png?h=300&w=458 "9-[3-(4-hydroxyphenyl)propyl]-12-isopropyl-3-methyl-6-methylene-1-oxa-4,7,10-triazacyclododecane-2,5,8,11-diquinone")
