Vitas-M small molecule compound

S-benzyl-N-[(7-hydroxy-2-oxo-2H-chromen-4-yl)acetyl]-D-cysteine

Catalog ID
STL464450
SMILES O=C(Cc1cc(=O)oc2c1ccc(c2)O)N[C@@H](C(=O)O)CSCc1ccccc1

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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 C21H19NO6S MW 413.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19NO6S/c23-15-6-7-16-14(9-20(25)28-18(16)10-15)8-19(24)22-17(21(26)27)12-29-11-13-4-2-1-3-5-13/h1-7,9-10,17,23H,8,11-12H2,(H,22,24)(H,26,27)/t17-/m1/s1
InChIKey
HUKWUYRJEKGMFU-QGZVFWFLSA-N
Synonyms

(2S)3benzylsulfanyl2((2(7hydroxy2oxochromen4yl)acetyl)amino)propanoicacid
(R)3(benzylthio)2(2(7hydroxy2oxo2Hchromen4yl)acetamido)propanoicacid
C1=CC=C(C=C1)CSCC(C(=O)O)NC(=O)CC2=CC(=O)OC3=C2C=CC(=C3)O
InChI=1SC21H19NO6Sc2315671614(920(25)2818(16)1015)819(24)2217(21(26)27)122911134213513h179101723H81112H2(H2224)(H2627)t17m1s1
O=C(Cc1cc(=O)oc2c1ccc(c2)O)N(C@@H)(C(=O)O)CSCc1ccccc1
O=C(Cc1cc(=O)oc2c1ccc(c2)O)N(C@H)(C(=O)O)CSCc1ccccc1
SbenzylN((7hydroxy2oxo2Hchromen4yl)acetyl)Dcysteine
ZINC000011865672
ZINC11865672

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Available files

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