Vitas-M small molecule compound
N-{[(6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl)oxy]acetyl}-L-valyl-L-alanine
Catalog ID
STL461061
SMILES O=C(N[C@H](C(=O)N[C@H](C(=O)O)C)C(C)C)COc1ccc2c(c1)oc(=O)c1c2CCCC1
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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/c1-12(2)20(21(27)24-13(3)22(28)29)25-19(26)11-31-14-8-9-16-15-6-4-5-7-17(15)23(30)32-18(16)10-14/h8-10,12-13,20H,4-7,11H2,1-3H3,(H,24,27)(H,25,26)(H,28,29)/t13-,20-/m0/s1InChIKey
OIQGFFMZWQWBET-RBZFPXEDSA-NSynonyms
(2S)2(((2S)3methyl2((2((6oxo78910tetrahydrobenzo(c)chromen3yl)oxy)acetyl)amino)butanoyl)amino)propanoicacid
(R)2((S)3methyl2(2((6oxo78910tetrahydro6Hbenzo(c)chromen3yl)oxy)acetamido)butanamido)propanoicacid
CC(C)C(C(=O)NC(C)C(=O)O)NC(=O)COC1=CC2=C(C=C1)C3=C(CCCC3)C(=O)O2
InChI=1SC23H28N2O7c112(2)20(21(27)2413(3)22(28)29)2519(26)113114891615645717(15)23(30)3218(16)1014h810121320H4711H213H3(H2427)(H2526)(H2829)t1320m0s1
MFCD10040728
N(((6oxo78910tetrahydro6Hbenzo(c)chromen3yl)oxy)acetyl)LvalylLalanine
O=C(N(C@H)(C(=O)N(C@@H)(C(=O)O)C)C(C)C)COc1ccc2c(c1)oc(=O)c1c2CCCC1
O=C(N(C@H)(C(=O)N(C@H)(C(=O)O)C)C(C)C)COc1ccc2c(c1)oc(=O)c1c2CCCC1
ZINC000011866875
ZINC11866875
Check stock
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Check stock on Vitas-MAvailable files
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