| SpectraBase Spectrum ID |
EC7XM1QxEel |
| Name |
Pentanedioic acid, ethyl 2,3,5,7a-tetrahydro-7-(hydroxymethyl)-1H-pyrrolizin-1-ylester, (1R-trans)- |
| CAS Registry Number |
63128-37-0 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H23NO5 |
| InChI |
InChI=1S/C15H23NO5/c1-2-20-13(18)4-3-5-14(19)21-12-7-9-16-8-6-11(10-17)15(12)16/h6,12,15,17H,2-5,7-10H2,1H3/t12-,15-/m1/s1 |
| InChIKey |
RHVBMGNBFIPIEU-IUODEOHRSA-N |
| Molecular Weight |
297.351 g/mol |
| SMILES |
OCC=1[C@@]2([C@](OC(=O)CCCC(=O)OCC)(CCN2CC1)[H])[H] |
| SPLASH |
splash10-001l-9300000000-f034e372e2913ea94d5a |
| Source of Spectrum |
KC-1977-542-0 |
| Synonyms |
1-[(1R,7aR)-7-(hydroxymethyl)-2,3,5,7a-tetrahydro-1H-pyrrolo[1,2-a]pyrrol-1-yl]5-ethyl pentanedioate
Mixture of 9-O-(4-ethoxycarbonylbutanoyl)retronecine and 7-O-isomer
Retronecine 1-(ethyl glutarate) |
| Wiley ID |
1300042 |
