Vitas-M small molecule compound
N-{[(6-methyl-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl)oxy]acetyl}glycyl-D-isoleucine
Catalog ID
STL530078
SMILES CC[C@H]([C@H](C(=O)O)NC(=O)CNC(=O)COc1ccc2c(c1C)oc(=O)c1c2CCC1)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 C23H28N2O7 MW 444.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N2O7/c1-4-12(2)20(22(28)29)25-18(26)10-24-19(27)11-31-17-9-8-15-14-6-5-7-16(14)23(30)32-21(15)13(17)3/h8-9,12,20H,4-7,10-11H2,1-3H3,(H,24,27)(H,25,26)(H,28,29)/t12-,20-/m1/s1InChIKey
GLNCOTXYXGERHA-MPBGBICISA-NSynonyms
(2~(R)3~(R))3methyl2((2((2((6methyl4oxo23dihydro1~(H)cyclopenta(c)chromen7yl)oxy)acetyl)amino)acetyl)amino)pentanoicacid
(2S3S)3methyl2(2(2((6methyl4oxo1234tetrahydrocyclopenta(c)chromen7yl)oxy)acetamido)acetamido)pentanoicacid
124358122
CC(C@@H)((C@@H)(C(=O)O)NC(=O)CNC(=O)COc1ccc2c(c1C)oc(=O)c1c2CCC1)C
InChI=1SC23H28N2O7c1412(2)20(22(28)29)2518(26)102419(27)11311798151465716(14)23(30)3221(15)13(17)3h891220H471011H213H3(H2427)(H2526)(H2829)t1220m1s1
N(((6methyl4oxo1234tetrahydrocyclopenta(c)chromen7yl)oxy)acetyl)glycylDisoleucine
ZINC000015956458
ZINC15956458
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