Vitas-M small molecule compound

S-benzyl-N-[(3,4,9-trimethyl-7-oxo-7H-furo[2,3-f]chromen-8-yl)acetyl]-L-cysteine

Catalog ID
STK609778
SMILES O=C(Cc1c(=O)oc2c(c1C)c1occ(c1c(c2)C)C)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 C26H25NO6S MW 479.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25NO6S/c1-14-9-20-23(24-22(14)15(2)11-32-24)16(3)18(26(31)33-20)10-21(28)27-19(25(29)30)13-34-12-17-7-5-4-6-8-17/h4-9,11,19H,10,12-13H2,1-3H3,(H,27,28)(H,29,30)/t19-/m0/s1
InChIKey
MUQCMRLYSKORIV-IBGZPJMESA-N
Synonyms
956687-95-9
(2R)3benzylsulfanyl2((2(349trimethyl7oxofuro(23f)chromen8yl)acetyl)amino)propanoicacid
(R)3(benzylthio)2(2(349trimethyl7oxo7Hfuro(23f)chromen8yl)acetamido)propanoicacid
956687959
CC1=CC2=C(C(=C(C(=O)O2)CC(=O)NC(CSCC3=CC=CC=C3)C(=O)O)C)C4=C1C(=CO4)C
InChI=1SC26H25NO6Sc11492023(2422(14)15(2)113224)16(3)18(26(31)3320)1021(28)2719(25(29)30)133412177546817h491119H101213H213H3(H2728)(H2930)t19m0s1
MFCD08291354
O=C(Cc1c(=O)oc2c(c1C)c1occ(c1c(c2)C)C)N(C@H)(C(=O)O)CSCc1ccccc1
SbenzylN((349trimethyl7oxo7Hfuro(23f)chromen8yl)acetyl)Lcysteine
ZINC000009435305
ZINC9435305

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.