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N-[3-(3-tert-butyl-5,9-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoyl]-L-leucyl-S-benzyl-L-cysteine

Catalog ID
STK593454
SMILES CC(C[C@@H](C(=O)N[C@H](C(=O)O)CSCc1ccccc1)NC(=O)CCc1c(=O)oc2c(c1C)cc1c(c2C)occ1C(C)(C)C)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 C36H44N2O7S MW 648.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H44N2O7S/c1-20(2)15-28(33(40)38-29(34(41)42)19-46-18-23-11-9-8-10-12-23)37-30(39)14-13-24-21(3)25-16-26-27(36(5,6)7)17-44-31(26)22(4)32(25)45-35(24)43/h8-12,16-17,20,28-29H,13-15,18-19H2,1-7H3,(H,37,39)(H,38,40)(H,41,42)/t28-,29-/m0/s1
InChIKey
RVUMNZBNHYKCAY-VMPREFPWSA-N
Synonyms
1014003-48-5
(2R)3benzylsulfanyl2(((2S)2(3(3tertbutyl59dimethyl7oxofuro(32g)chromen6yl)propanoylamino)4methylpentanoyl)amino)propanoicacid
(R)3(benzylthio)2((S)2(3(3(tertbutyl)59dimethyl7oxo7Hfuro(32g)chromen6yl)propanamido)4methylpentanamido)propanoicacid
1014003485
CC(C(C@@H)(C(=O)N(C@H)(C(=O)O)CSCc1ccccc1)NC(=O)CCc1c(=O)oc2c(c1C)cc1c(c2C)occ1C(C)(C)C)C
CC1=C(C(=O)OC2=C1C=C3C(=COC3=C2C)C(C)(C)C)CCC(=O)NC(CC(C)C)C(=O)NC(CSCC4=CC=CC=C4)C(=O)O
InChI=1SC36H44N2O7Sc120(2)1528(33(40)3829(34(41)42)194618231198101223)3730(39)14132421(3)25162627(36(56)7)174431(26)22(4)32(25)4535(24)43h8121617202829H13151819H217H3(H3739)(H3840)(H4142)t2829m0s1
MFCD18245962
N(3(3tertbutyl59dimethyl7oxo7Hfuro(32g)chromen6yl)propanoyl)LleucylSbenzylLcysteine
ZINC000097957062
ZINC97957062

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Available files

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