Vitas-M small molecule compound
(12aS)-6-(3,4-dimethoxyphenyl)-2-[3-(propan-2-yloxy)propyl]-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL540310
SMILES COc1cc(ccc1OC)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CCCOC(C)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 C28H33N3O5 MW 491.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H33N3O5/c1-17(2)36-13-7-12-30-16-25(32)31-22(28(30)33)15-20-19-8-5-6-9-21(19)29-26(20)27(31)18-10-11-23(34-3)24(14-18)35-4/h5-6,8-11,14,17,22,27,29H,7,12-13,15-16H2,1-4H3/t22-,27?/m0/s1InChIKey
FSSUTBDDFQJFIS-YMQLSTQVSA-NSynonyms
956708-81-9(12aS)6(34dimethoxyphenyl)2(3(propan2yloxy)propyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(12aS)6(34dimethoxyphenyl)2(3isopropoxypropyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(8~(S))2(34dimethoxyphenyl)6(3propan2yloxypropyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16399788
956708819
COc1cc(ccc1OC)C1N2C(=O)CN(C(=O)(C@@H)2Cc2c1(nH)c1c2cccc1)CCCOC(C)C
InChI=1SC28H33N3O5c117(2)3613712301625(32)3122(28(30)33)152019856921(19)2926(20)27(31)18101123(343)24(1418)354h568111417222729H712131516H214H3t2227?m0s1
MFCD04145686
ZINC000002103961
ZINC000002103963
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