| SpectraBase Spectrum ID |
GoeOaCcUALV |
| Name |
Vobasan-17-oic acid, 3-oxo-, methyl ester |
| CAS Registry Number |
2134-83-0 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H24N2O3 |
| InChI |
InChI=1S/C21H24N2O3/c1-4-12-11-23(2)17-9-15-13-7-5-6-8-16(13)22-20(15)18(24)10-14(12)19(17)21(25)26-3/h4-8,14,17,19,22H,9-11H2,1-3H3/b12-4-/t14-,17-,19?/m1/s1 |
| InChIKey |
TYPMTMPLTVSOBU-IKNQGWKJSA-N |
| Molecular Weight |
352.434 g/mol |
| SMILES |
c12c([nH]c3c2cccc3)C(C[C@]2(C([C@@](C1)(N(C\C2=C/C)C)[H])C(=O)OC)[H])=O |
| SPLASH |
splash10-001i-0910000000-9395d1af43e6dbdb8ef1 |
| Source of Spectrum |
AC-63-1901-2 |
| Synonyms |
Methyl (19trans)-3-oxovobasan-17-oate
(-)-Vobasine
Methyl 3-oxovobasan-17-oate
Vobasin
NSC 267706 |
| Wiley ID |
1343406 |
