| SpectraBase Spectrum ID |
1zwxjilYTxR |
| Name |
(-)-3-{[2-(.beta.-N-Methylaminoethyl)-6-methoxy-4,5-methylenedioxyphenyl]hydroxymethyl}-6,7-dimethoxy-1(3H)-isobenzofuranone isomer |
| Alternate Name(s) |
3-(hydroxy{4-methoxy-6-[2-(methylamino)ethyl]-1,3-benzodioxol-5-yl}methyl)-6,7-dimethoxy-2-benzofuran-1(3H)-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H25NO8 |
| InChI |
InChI=1S/C22H25NO8/c1-23-8-7-11-9-14-20(30-10-29-14)21(28-4)15(11)17(24)18-12-5-6-13(26-2)19(27-3)16(12)22(25)31-18/h5-6,9,17-18,23-24H,7-8,10H2,1-4H3 |
| InChIKey |
XAIIZYWKRNIQNX-UHFFFAOYSA-N |
| Molecular Weight |
431.441 g/mol |
| SMILES |
N(CCc1cc2OCOc2c(c1C(C1c2c(C(O1)=O)c(c(cc2)OC)OC)O)OC)C |
| SPLASH |
splash10-052r-0090000000-2b2005f6e1a9e1e76a52 |
| Source of Spectrum |
E1-39-1948-7 |
| Wiley ID |
1518910 |
![(-)-3-{[2-(.beta.-N-Methylaminoethyl)-6-methoxy-4,5-methylenedioxyphenyl]hydroxymethyl}-6,7-dimethoxy-1(3H)-isobenzofuranone isomer](/api/spectrum/1zwxjilYTxR/structure.png?h=300&w=458 "(-)-3-{[2-(.beta.-N-Methylaminoethyl)-6-methoxy-4,5-methylenedioxyphenyl]hydroxymethyl}-6,7-dimethoxy-1(3H)-isobenzofuranone isomer")
