Vitas-M small molecule compound
methyl 3-(5-amino-8-methoxy-1,3,6-trioxo-3,3a,11b,11c-tetrahydro-6H-chromeno[4',3':4,5]thiopyrano[2,3-c]pyrrol-2(1H)-yl)-4-methoxybenzoate
Catalog ID
STL318958
SMILES COc1ccc(cc1N1C(=O)C2C(C1=O)C1C(=C(S2)N)C(=O)Oc2c1cccc2OC)C(=O)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 C24H20N2O8S MW 496.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20N2O8S/c1-31-13-8-7-10(23(29)33-3)9-12(13)26-21(27)16-15-11-5-4-6-14(32-2)18(11)34-24(30)17(15)20(25)35-19(16)22(26)28/h4-9,15-16,19H,25H2,1-3H3InChIKey
ZUXBWOKXELQEJF-UHFFFAOYSA-NSynonyms
1436000-98-41436000984
COC1=C(C=C(C=C1)C(=O)OC)N2C(=O)C3C4C5=C(C(=CC=C5)OC)OC(=O)C4=C(SC3C2=O)N
InChI=1SC24H20N2O8Sc131138710(23(29)333)912(13)2621(27)16151154614(322)18(11)3424(30)17(15)20(25)3519(16)22(26)28h49151619H25H213H3
methyl3(5amino8methoxy136trioxo33a11b11ctetrahydro6Hchromeno(4345)thiopyrano(23c)pyrrol2(1H)yl)4methoxybenzoate
methyl3(5amino8methoxy136trioxo33adihydro1Hchromeno(4345)thiopyrano(23c)pyrrol2(6H11bH11cH)yl)4methoxybenzoate
MFCD23137188
ZINC000101362539
ZINC000245313084
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