Vitas-M small molecule compound
2-[4-(8-methoxy-2-oxo-2H-chromen-3-yl)phenoxy]-N-[(1S,9aR)-octahydro-2H-quinolizin-1-ylmethyl]acetamide
Catalog ID
STL539959
SMILES COc1cccc2c1oc(=O)c(c2)c1ccc(cc1)OCC(=O)NC[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 C28H32N2O5 MW 476.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H32N2O5/c1-33-25-9-4-6-20-16-23(28(32)35-27(20)25)19-10-12-22(13-11-19)34-18-26(31)29-17-21-7-5-15-30-14-3-2-8-24(21)30/h4,6,9-13,16,21,24H,2-3,5,7-8,14-15,17-18H2,1H3,(H,29,31)/t21-,24+/m0/s1InChIKey
KXDXZQRYHONDHC-XUZZJYLKSA-NSynonyms
~(N)(((1~(S)9~(a)~(R))23467899~(a)octahydro1~(H)quinolizin1yl)methyl)2(4(8methoxy2oxochromen3yl)phenoxy)acetamide
2(4(8methoxy2oxo2Hchromen3yl)phenoxy)N(((1S9aR)octahydro1Hquinolizin1yl)methyl)acetamide
2(4(8methoxy2oxo2Hchromen3yl)phenoxy)N((1S9aR)octahydro2Hquinolizin1ylmethyl)acetamide
71753812
COc1cccc2c1oc(=O)c(c2)c1ccc(cc1)OCC(=O)NC(C@@H)1CCCN2(C@@H)1CCCC2
InChI=1SC28H32N2O5c13325946201623(28(32)3527(20)25)19101222(131119)341826(31)2917217515301432824(21)30h46913162124H2357814151718H21H3(H2931)t2124+m0s1
ZINC000085874644
ZINC85874644
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