Vitas-M small molecule compound
4-[(N-{3-(1,3-benzodioxol-5-yl)-3-[(3S,11E)-14,16-dihydroxy-3-methyl-1,7-dioxo-3,4,5,6,7,8,9,10-octahydro-1H-2-benzoxacyclotetradecin-15-yl]propanoyl}glycyl)amino]benzamide
Catalog ID
STL562100
SMILES O=C1CCC/C=C/c2cc(O)c(c(c2C(=O)O[C@H](CCC1)C)O)C(c1ccc2c(c1)OCO2)CC(=O)NCC(=O)Nc1ccc(cc1)C(=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 C37H39N3O10 MW 685.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H39N3O10/c1-21-6-5-9-26(41)8-4-2-3-7-24-16-28(42)34(35(45)33(24)37(47)50-21)27(23-12-15-29-30(17-23)49-20-48-29)18-31(43)39-19-32(44)40-25-13-10-22(11-14-25)36(38)46/h3,7,10-17,21,27,42,45H,2,4-6,8-9,18-20H2,1H3,(H2,38,46)(H,39,43)(H,40,44)/b7InChIKey
MIUCDBHESUKLIS-ZAGAWNJGSA-NSynonyms
145705451
4((2((3(13benzodioxol5yl)3((4S12E)1618dihydroxy4methyl28dioxo3oxabicyclo(1240)octadeca1(18)121416tetraen17yl)propanoyl)amino)acetyl)amino)benzamide
4((N(3(13benzodioxol5yl)3((3S11E)1416dihydroxy3methyl17dioxo345678910octahydro1H2benzoxacyclotetradecin15yl)propanoyl)glycyl)amino)benzamide
4(2(3(benzo(d)(13)dioxol5yl)3((SE)1416dihydroxy3methyl17dioxo345678910octahydro1Hbenzo(c)(1)oxacyclotetradecin15yl)propanamido)acetamido)benzamide
InChI=1SC37H39N3O10c12165926(41)84237241628(42)34(35(45)33(24)37(47)5021)27(2312152930(1723)49204829)1831(43)391932(44)4025131022(111425)36(38)46h37101721274245H246891820H21H3(H23846)(H3943)(H4044)b73+t2127?m0s1
MFCD32651154
O=C1CCCC=Cc2cc(O)c(c(c2C(=O)O(C@H)(CCC1)C)O)C(c1ccc2c(c1)OCO2)CC(=O)NCC(=O)Nc1ccc(cc1)C(=O)N
ZINC001848443382
ZINC001848443383
Check stock
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