Vitas-M small molecule compound

N-[(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]-D-leucine

Catalog ID
STL463552
SMILES CC(C[C@H](C(=O)O)NC(=O)Cc1c(=O)oc2c(c1C)cc(c(c2)O)Cl)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 C18H20ClNO6 MW 381.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20ClNO6/c1-8(2)4-13(17(23)24)20-16(22)6-11-9(3)10-5-12(19)14(21)7-15(10)26-18(11)25/h5,7-8,13,21H,4,6H2,1-3H3,(H,20,22)(H,23,24)/t13-/m1/s1
InChIKey
IGAYVHQLLWGOTO-CYBMUJFWSA-N
Synonyms

(2R)2((2(6chloro7hydroxy4methyl2oxochromen3yl)acetyl)amino)4methylpentanoicacid
(S)2(2(6chloro7hydroxy4methyl2oxo2Hchromen3yl)acetamido)4methylpentanoicacid
CC(C(C@@H)(C(=O)O)NC(=O)Cc1c(=O)oc2c(c1C)cc(c(c2)O)Cl)C
CC(C(C@H)(C(=O)O)NC(=O)Cc1c(=O)oc2c(c1C)cc(c(c2)O)Cl)C
CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)O)CC(=O)NC(CC(C)C)C(=O)O
InChI=1SC18H20ClNO6c18(2)413(17(23)24)2016(22)6119(3)10512(19)14(21)715(10)2618(11)25h5781321H46H213H3(H2022)(H2324)t13m1s1
N((6chloro7hydroxy4methyl2oxo2Hchromen3yl)acetyl)Dleucine
ZINC000011865467
ZINC11865467

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Available files

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