Vitas-M small molecule compound
2-[1-(4-methoxyphenyl)ethyl]-1-oxo-N-(3,4,5-trimethoxyphenyl)-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxamide
Catalog ID
STL058429
SMILES COc1ccc(cc1)C(N1CC23C(C1=O)C(C(O3)C=C2)C(=O)Nc1cc(OC)c(c(c1)OC)OC)C
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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 C27H30N2O7 MW 494.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N2O7/c1-15(16-6-8-18(32-2)9-7-16)29-14-27-11-10-19(36-27)22(23(27)26(29)31)25(30)28-17-12-20(33-3)24(35-5)21(13-17)34-4/h6-13,15,19,22-23H,14H2,1-5H3,(H,28,30)InChIKey
OGBTXWYUPRCYQA-UHFFFAOYSA-NSynonyms
1212240-06-6(3aS6R)2(1(4methoxyphenyl)ethyl)1oxoN(345trimethoxyphenyl)123677ahexahydro3a6epoxyisoindole7carboxamide
1212240066
2(1(4methoxyphenyl)ethyl)1oxoN(345trimethoxyphenyl)123677ahexahydro3a6epoxyisoindole7carboxamide
CC(C1=CC=C(C=C1)OC)N2CC34C=CC(O3)C(C4C2=O)C(=O)NC5=CC(=C(C(=C5)OC)OC)OC
COc1ccc(cc1)(C@@H)(N1C(C@@)23(C@H)(C1=O)(C@@H)((C@H)(O3)C=C2)C(=O)Nc1cc(OC)c(c(c1)OC)OC)C
InChI=1SC27H30N2O7c115(166818(322)9716)291427111019(3627)22(23(27)26(29)31)25(30)28171220(333)24(355)21(1317)344h61315192223H14H215H3(H2830)
MFCD08291938
ZINC000009435719
ZINC000245246800
Check stock
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Check stock on Vitas-MAvailable files
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