Vitas-M small molecule compound

(2S)-({2-[(7-methyl-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-9-yl)oxy]propanoyl}amino)(phenyl)ethanoic acid

Catalog ID
STL460921
SMILES O=C(C(Oc1cc(C)cc2c1c1CCCc1c(=O)o2)C)N[C@@H](c1ccccc1)C(=O)O

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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 C24H23NO6 MW 421.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23NO6/c1-13-11-18(20-16-9-6-10-17(16)24(29)31-19(20)12-13)30-14(2)22(26)25-21(23(27)28)15-7-4-3-5-8-15/h3-5,7-8,11-12,14,21H,6,9-10H2,1-2H3,(H,25,26)(H,27,28)/t14?,21-/m0/s1
InChIKey
DSAGYHKERFGOOJ-YNNZGITBSA-N
Synonyms
957015-42-8
(2S)((2((7methyl4oxo1234tetrahydrocyclopenta(c)chromen9yl)oxy)propanoyl)amino)(phenyl)ethanoicacid
(2S)2(2((7methyl4oxo1234tetrahydrocyclopenta(c)chromen9yl)oxy)propanamido)2phenylaceticacid
(2S)2(2((7methyl4oxo23dihydro1Hcyclopenta(c)chromen9yl)oxy)propanoylamino)2phenylaceticacid
957015428
CC1=CC2=C(C3=C(CCC3)C(=O)O2)C(=C1)OC(C)C(=O)NC(C4=CC=CC=C4)C(=O)O
InChI=1SC24H23NO6c1131118(2016961017(16)24(29)3119(20)1213)3014(2)22(26)2521(23(27)28)157435815h357811121421H6910H212H3(H2526)(H2728)t14?21m0s1
O=C(C(Oc1cc(C)cc2c1c1CCCc1c(=O)o2)C)N(C@@H)(c1ccccc1)C(=O)O
ZINC000004037430
ZINC000004037438

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Available files

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