Vitas-M small molecule compound
N-(2-{[3-(4-hydroxy-3-methoxyphenyl)-3-(3-hydroxy-6-methyl-4-oxo-4H-pyran-2-yl)propanoyl]amino}ethyl)-1H-indole-2-carboxamide
Catalog ID
STL551077
SMILES COc1cc(ccc1O)C(c1oc(C)cc(=O)c1O)CC(=O)NCCNC(=O)c1cc2c([nH]1)cccc2
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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 C27H27N3O7 MW 505.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N3O7/c1-15-11-22(32)25(34)26(37-15)18(16-7-8-21(31)23(13-16)36-2)14-24(33)28-9-10-29-27(35)20-12-17-5-3-4-6-19(17)30-20/h3-8,11-13,18,30-31,34H,9-10,14H2,1-2H3,(H,28,33)(H,29,35)InChIKey
WBNICPMNHUYKHI-UHFFFAOYSA-NSynonyms
~(N)(2((3(4hydroxy3methoxyphenyl)3(3hydroxy6methyl4oxopyran2yl)propanoyl)amino)ethyl)1~(H)indole2carboxamide
129895057
COc1cc(ccc1O)C(c1oc(C)cc(=O)c1O)CC(=O)NCCNC(=O)c1cc2c((nH)1)cccc2
InChI=1SC27H27N3O7c1151122(32)25(34)26(3715)18(167821(31)23(1316)362)1424(33)289102927(35)201217534619(17)3020h38111318303134H91014H212H3(H2833)(H2935)
MFCD31757935
N(2((3(4hydroxy3methoxyphenyl)3(3hydroxy6methyl4oxo4Hpyran2yl)propanoyl)amino)ethyl)1Hindole2carboxamide
N(2(3(4hydroxy3methoxyphenyl)3(3hydroxy6methyl4oxo4Hpyran2yl)propanamido)ethyl)1Hindole2carboxamide
ZINC000524730107
ZINC000524730108
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