Vitas-M small molecule compound
N~2~-[(3-tert-butyl-5,9-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetyl]-N~5~-carbamoyl-D-ornithine
Catalog ID
STL464080
SMILES O=C(Cc1c(=O)oc2c(c1C)cc1c(c2C)occ1C(C)(C)C)N[C@@H](C(=O)O)CCCNC(=O)N
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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 C25H31N3O7 MW 485.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31N3O7/c1-12-14-9-16-17(25(3,4)5)11-34-20(16)13(2)21(14)35-23(32)15(12)10-19(29)28-18(22(30)31)7-6-8-27-24(26)33/h9,11,18H,6-8,10H2,1-5H3,(H,28,29)(H,30,31)(H3,26,27,33)/t18-/m1/s1InChIKey
JMOWXWVVSVIBKV-GOSISDBHSA-NSynonyms
(2R)2((2(3tertbutyl59dimethyl7oxofuro(32g)chromen6yl)acetyl)amino)5(carbamoylamino)pentanoicacid
(S)2(2(3(tertbutyl)59dimethyl7oxo7Hfuro(32g)chromen6yl)acetamido)5ureidopentanoicacid
CC1=C(C(=O)OC2=C1C=C3C(=COC3=C2C)C(C)(C)C)CC(=O)NC(CCCNC(=O)N)C(=O)O
InChI=1SC25H31N3O7c1121491617(25(34)5)113420(16)13(2)21(14)3523(32)15(12)1019(29)2818(22(30)31)7682724(26)33h91118H6810H215H3(H2829)(H3031)(H3262733)t18m1s1
N~2~((3tertbutyl59dimethyl7oxo7Hfuro(32g)chromen6yl)acetyl)N~5~carbamoylDornithine
N2((3TERTBUTYL59DIMETHYL7OXO7HFURO(32G)CHROMEN6YL)ACETYL)N5CARBAMOYLDORNITHINE
O=C(Cc1c(=O)oc2c(c1C)cc1c(c2C)occ1C(C)(C)C)N(C@@H)(C(=O)O)CCCNC(=O)N
O=C(Cc1c(=O)oc2c(c1C)cc1c(c2C)occ1C(C)(C)C)N(C@H)(C(=O)O)CCCNC(=O)N
ZINC000011865580
ZINC11865580
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