Vitas-M small molecule compound

6-hydroxy-7-[2-hydroxy-3-(naphthalen-2-yloxy)propyl]-3-methyl-8-[(2Z)-2-(2-oxo-1-propyl-1,2-dihydro-3H-indol-3-ylidene)hydrazinyl]-3,7-dihydro-2H-purin-2-one

Catalog ID
STL042373
SMILES CCCN1C(=O)/C(=N\Nc2nc3c(n2CC(COc2ccc4c(c2)cccc4)O)c(O)nc(=O)n3C)/c2c1cccc2

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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 C30H29N7O5 MW 567.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29N7O5/c1-3-14-36-23-11-7-6-10-22(23)24(28(36)40)33-34-29-31-26-25(27(39)32-30(41)35(26)2)37(29)16-20(38)17-42-21-13-12-18-8-4-5-9-19(18)15-21/h4-13,15,20,38H,3,14,16-17H2,1-2H3,(H,31,34)(H,32,39,41)/b33-24-
InChIKey
XOZQQEGOQPDCFW-GIBOGKFOSA-N
Synonyms

6hydroxy7(2hydroxy3(naphthalen2yloxy)propyl)3methyl8((2Z)2(2oxo1propyl12dihydro3Hindol3ylidene)hydrazinyl)37dihydro2Hpurin2one
7(2HYDROXY3NAPHTHALEN2YLOXYPROPYL)3METHYL8((2Z)2(2OXO1PROPYLINDOL3YLIDENE)HYDRAZINYL)PURINE26DIONE
CCCN1C(=O)C(=NNc2nc3c(n2CC(COc2ccc4c(c2)cccc4)O)c(O)nc(=O)n3C)c2c1cccc2
CCCN1C2=CC=CC=C2C(=NNC3=NC4=C(N3CC(COC5=CC6=CC=CC=C6C=C5)O)C(=O)NC(=O)N4C)C1=O
InChI=1SC30H29N7O5c1314362311761022(23)24(28(36)40)333429312625(27(39)3230(41)35(26)2)37(29)1620(38)174221131218845919(18)1521h413152038H3141617H212H3(H3134)(H323941)b3324
MFCD05728960
ZINC000097969334
ZINC000097969335

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Available files

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