Vitas-M small molecule compound
N~5~-carbamoyl-N~2~-[3-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)propanoyl]-D-ornithine
Catalog ID
STL534353
SMILES O=C(N[C@@H](C(=O)O)CCCNC(=O)N)CCc1c(=O)oc2c(c1C)cc1c(c2C)oc(c1c1ccccc1)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 C29H31N3O7 MW 533.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31N3O7/c1-15-19(11-12-23(33)32-22(27(34)35)10-7-13-31-29(30)37)28(36)39-25-16(2)26-21(14-20(15)25)24(17(3)38-26)18-8-5-4-6-9-18/h4-6,8-9,14,22H,7,10-13H2,1-3H3,(H,32,33)(H,34,35)(H3,30,31,37)/t22-/m1/s1InChIKey
QQQLKSSNNNYPHC-JOCHJYFZSA-NSynonyms
(2~(R))5(carbamoylamino)2(3(259trimethyl7oxo3phenylfuro(32g)chromen6yl)propanoylamino)pentanoicacid
(S)2(3(259trimethyl7oxo3phenyl7Hfuro(32g)chromen6yl)propanamido)5ureidopentanoicacid
124537846
InChI=1SC29H31N3O7c11519(111223(33)3222(27(34)35)107133129(30)37)28(36)392516(2)2621(1420(15)25)24(17(3)3826)188546918h46891422H71013H213H3(H3233)(H3435)(H3303137)t22m1s1
N~5~carbamoylN~2~(3(259trimethyl7oxo3phenyl7Hfuro(32g)chromen6yl)propanoyl)Dornithine
N5CARBAMOYLN2(3(259TRIMETHYL7OXO3PHENYL7HFURO(32G)CHROMEN6YL)PROPANOYL)DORNITHINE
O=C(N(C@H)(C(=O)O)CCCNC(=O)N)CCc1c(=O)oc2c(c1C)cc1c(c2C)oc(c1c1ccccc1)C
ZINC000104578368
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