Vitas-M small molecule compound
(1S,9aS)-octahydro-2H-quinolizin-1-ylmethyl 4-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)benzoate
Catalog ID
STL542197
SMILES O=C1C=CC(=O)N1c1ccc(cc1)C(=O)OC[C@H]1CCCN2[C@H]1CCCC2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C21H24N2O4 MW 368.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O4/c24-19-10-11-20(25)23(19)17-8-6-15(7-9-17)21(26)27-14-16-4-3-13-22-12-2-1-5-18(16)22/h6-11,16,18H,1-5,12-14H2/t16-,18+/m1/s1InChIKey
SCDFNTOMPXCXDU-AEFFLSMTSA-NSynonyms
((1~(S)9~(a)~(S))23467899~(a)octahydro1~(H)quinolizin1yl)methyl4(25dioxopyrrol1yl)benzoate
((1R9aR)octahydro1Hquinolizin1yl)methyl4(25dioxo25dihydro1Hpyrrol1yl)benzoate
(1S9aS)octahydro2Hquinolizin1ylmethyl4(25dioxo25dihydro1Hpyrrol1yl)benzoate
7004469
InChI=1SC21H24N2O4c2419101120(25)23(19)178615(7917)21(26)2714164313221221518(16)22h6111618H151214H2t1618+m1s1
MFCD03005760
O=C1C=CC(=O)N1c1ccc(cc1)C(=O)OC(C@@H)1CCCN2(C@@H)1CCCC2
ZINC000026771697
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