Vitas-M small molecule compound
(12aS)-2-cyclohexyl-6-[3-methoxy-4-(propan-2-yloxy)phenyl]-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL548419
SMILES COc1cc(ccc1OC(C)C)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)C1CCCCC1
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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 C30H35N3O4 MW 501.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H35N3O4/c1-18(2)37-25-14-13-19(15-26(25)36-3)29-28-22(21-11-7-8-12-23(21)31-28)16-24-30(35)32(17-27(34)33(24)29)20-9-5-4-6-10-20/h7-8,11-15,18,20,24,29,31H,4-6,9-10,16-17H2,1-3H3/t24-,29?/m0/s1InChIKey
FGVPASHGLKVFSL-CTLOQAHHSA-NSynonyms
956990-99-1(12aS)2cyclohexyl6(3methoxy4(propan2yloxy)phenyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(12aS)2cyclohexyl6(4isopropoxy3methoxyphenyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(8~(S))6cyclohexyl2(3methoxy4propan2yloxyphenyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16400865
956990991
COc1cc(ccc1OC(C)C)C1N2C(=O)CN(C(=O)(C@@H)2Cc2c1(nH)c1c2cccc1)C1CCCCC1
InChI=1SC30H35N3O4c118(2)3725141319(1526(25)363)292822(2111781223(21)3128)162430(35)32(1727(34)33(24)29)2095461020h7811151820242931H469101617H213H3t2429?m0s1
MFCD05672156
ZINC000002111944
ZINC000002111946
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