| SpectraBase Spectrum ID |
3FY14d4LCEK |
| Name |
2,3-Dimethyl-2-[(4-methoxybenzyl)oxy]pentan-1,5-dioic diacid retronecine ester |
| Alternate Name(s) |
(4aR,12bR)-9-(4-Methoxy-benzyloxy)-8,9-dimethyl-2,3,4,4a,8,9,12,12b-octahydro-7H-5,11-dioxa-2a-aza-cycloundeca[cd]pentalene-6,10-dione
(4aR,12bR)-9-[(4-methoxybenzyl)oxy]-8,9-dimethyl-2,3,4,4a,8,9,12,12b-octahydro-6H-5,11-dioxa-2a-azacycloundeca[cd]pentalene-6,10(7H)-dione |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H29NO6 |
| InChI |
InChI=1S/C23H29NO6/c1-15-12-20(25)30-19-9-11-24-10-8-17(21(19)24)14-28-22(26)23(15,2)29-13-16-4-6-18(27-3)7-5-16/h4-8,15,19,21H,9-14H2,1-3H3/t15?,19-,21-,23?/m1/s1 |
| InChIKey |
INVJZTSCXDAUQG-WPEFVTBTSA-N |
| Molecular Weight |
415.486 g/mol |
| SMILES |
C1(C(OCC=2[C@]3(N(CC2)CC[C@]3(OC(CC1C)=O)[H])[H])=O)(OCc1ccc(cc1)OC)C |
| SPLASH |
splash10-00di-0920000000-35dfeb633b40dbf0f1a5 |
| Source of Spectrum |
J-61-1476-10 |
| Wiley ID |
1376009 |
![2,3-Dimethyl-2-[(4-methoxybenzyl)oxy]pentan-1,5-dioic diacid retronecine ester](/api/spectrum/3FY14d4LCEK/structure.png?h=300&w=458 "2,3-Dimethyl-2-[(4-methoxybenzyl)oxy]pentan-1,5-dioic diacid retronecine ester")
