Vitas-M small molecule compound
[6'-amino-5'-cyano-2-oxo-3'-(3,4,5-trimethoxyphenyl)-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazol]-1(2H)-yl]acetic acid
Catalog ID
STK677564
SMILES N#CC1=C(N)Oc2c(C31c1ccccc1N(C3=O)CC(=O)O)c(n[nH]2)c1cc(OC)c(c(c1)OC)OC
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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 C25H21N5O7 MW 503.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N5O7/c1-34-16-8-12(9-17(35-2)21(16)36-3)20-19-23(29-28-20)37-22(27)14(10-26)25(19)13-6-4-5-7-15(13)30(24(25)33)11-18(31)32/h4-9H,11,27H2,1-3H3,(H,28,29)(H,31,32)InChIKey
MQHQDDVVWMJMDT-UHFFFAOYSA-NSynonyms
(6amino5cyano2oxo3(345trimethoxyphenyl)1Hspiro(indole34pyrano(23c)pyrazol)1(2H)yl)aceticacid
2(6AMINO5CYANO11OXO3(345TRIMETHOXYPHENYL)SPIRO(4HPYRANO(32D)PYRAZOLE43INDOLINE)10YL)ACETICACID
2(6AMINO5CYANO2OXO3(345TRIMETHOXYPHENYL)SPIRO(2HPYRANO(23C)PYRAZOLE43INDOLE)1YL)ACETICACID
COC1=CC(=CC(=C1OC)OC)C2=C3C(=NN2)OC(=C(C34C5=CC=CC=C5N(C4=O)CC(=O)O)C#N)N
InChI=1SC25H21N5O7c13416812(917(352)21(16)363)201923(292820)3722(27)14(1026)25(19)13645715(13)30(24(25)33)1118(31)32h49H1127H213H3(H2829)(H3132)
MFCD03035615
N#CC1=C(N)Oc2c(C31c1ccccc1N(C3=O)CC(=O)O)c(n(nH)2)c1cc(OC)c(c(c1)OC)OC
ZINC000008925928
ZINC000008925929
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.