Vitas-M small molecule compound

N-{2-[(7-methyl-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-9-yl)oxy]propanoyl}-L-methionine

Catalog ID
STL460920
SMILES CSCC[C@@H](C(=O)O)NC(=O)C(Oc1cc(C)cc2c1c1CCCc1c(=O)o2)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 C21H25NO6S MW 419.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25NO6S/c1-11-9-16(18-13-5-4-6-14(13)21(26)28-17(18)10-11)27-12(2)19(23)22-15(20(24)25)7-8-29-3/h9-10,12,15H,4-8H2,1-3H3,(H,22,23)(H,24,25)/t12?,15-/m0/s1
InChIKey
VAUGZIRBCJRMHN-CVRLYYSRSA-N
Synonyms
956977-07-4
(2S)2(2((7methyl4oxo1234tetrahydrocyclopenta(c)chromen9yl)oxy)propanamido)4(methylthio)butanoicacid
(2S)2(2((7methyl4oxo23dihydro1Hcyclopenta(c)chromen9yl)oxy)propanoylamino)4methylsulfanylbutanoicacid
956977074
CC1=CC2=C(C3=C(CCC3)C(=O)O2)C(=C1)OC(C)C(=O)NC(CCSC)C(=O)O
CSCC(C@@H)(C(=O)O)NC(=O)C(Oc1cc(C)cc2c1c1CCCc1c(=O)o2)C
InChI=1SC21H25NO6Sc111916(181354614(13)21(26)2817(18)1011)2712(2)19(23)2215(20(24)25)78293h9101215H48H213H3(H2223)(H2425)t12?15m0s1
N(2((7methyl4oxo1234tetrahydrocyclopenta(c)chromen9yl)oxy)propanoyl)Lmethionine
ZINC000002115022
ZINC000002115024

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Available files

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