Vitas-M small molecule compound

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]-3-(4-methoxyphenyl)-N-(2-{5-[(2-oxopyridin-1(2H)-yl)methyl]-1,2,4-oxadiazol-3-yl}ethyl)propanamide

Catalog ID
STL562099
SMILES COc1ccc(cc1)C(c1c(O)cc2c(c1O)C(=O)O[C@@H](C)CCCC(=O)CCC/C=C/2)CC(=O)NCCc1noc(n1)Cn1ccccc1=O

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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 C38H42N4O9 MW 698.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H42N4O9/c1-24-9-8-12-27(43)11-5-3-4-10-26-21-30(44)36(37(47)35(26)38(48)50-24)29(25-14-16-28(49-2)17-15-25)22-32(45)39-19-18-31-40-33(51-41-31)23-42-20-7-6-13-34(42)46/h4,6-7,10,13-17,20-21,24,29,44,47H,3,5,8-9,11-12,18-19,22-23H2,1-2H3,(H,39,
InChIKey
ZGPYXNOIDNIDSL-QBNZRYOSSA-N
Synonyms

145705450
3((3S11E)1416dihydroxy3methyl17dioxo345678910octahydro1H2benzoxacyclotetradecin15yl)3(4methoxyphenyl)N(2(5((2oxopyridin1(2H)yl)methyl)124oxadiazol3yl)ethyl)propanamide
3((4S12E)1618dihydroxy4methyl28dioxo3oxabicyclo(1240)octadeca1(18)121416tetraen17yl)3(4methoxyphenyl)N(2(5((2oxopyridin1yl)methyl)124oxadiazol3yl)ethyl)propanamide
3((SE)1416dihydroxy3methyl17dioxo345678910octahydro1Hbenzo(c)(1)oxacyclotetradecin15yl)3(4methoxyphenyl)N(2(5((2oxopyridin1(2H)yl)methyl)124oxadiazol3yl)ethyl)propanamide
COc1ccc(cc1)C(c1c(O)cc2c(c1O)C(=O)O(C@@H)(C)CCCC(=O)CCCC=C2)CC(=O)NCCc1noc(n1)Cn1ccccc1=O
InChI=1SC38H42N4O9c124981227(43)1153410262130(44)36(37(47)35(26)38(48)5024)29(25141628(492)171525)2232(45)391918314033(514131)234220761334(42)46h467101317202124294447H3589111218192223H212H3(H3945)b104+t2429?m0s1
MFCD32651153
ZINC001848443540
ZINC001848443541

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Available files

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