Vitas-M small molecule compound
2-[(2R,6'R)-7-chloro-4,6-dimethoxy-2'-(4-methoxyphenyl)-6'-methyl-3,4'-dioxo-6',7'-dihydro-3H,4'H-2,5'-spirobi[[1]benzofuran]-3'-yl]-N-hexadecylacetamide
Catalog ID
STL562082
SMILES CCCCCCCCCCCCCCCCNC(=O)Cc1c(oc2c1C(=O)[C@]1([C@@H](C2)C)Oc2c(C1=O)c(OC)cc(c2Cl)OC)c1ccc(cc1)OC
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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 C43H56ClNO8 MW 750.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C43H56ClNO8/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24-45-35(46)26-31-36-33(52-39(31)29-20-22-30(49-3)23-21-29)25-28(2)43(41(36)47)42(48)37-32(50-4)27-34(51-5)38(44)40(37)53-43/h20-23,27-28H,6-19,24-26H2,1-5H3,(H,45,46)/t28-,43+/m1/s1InChIKey
ZCYBNLFZVNENJS-KPRDSAADSA-NSynonyms
145705433
2((2R6R)7chloro46dimethoxy2(4methoxyphenyl)6methyl34dioxo67dihydro3H4H25spirobi((1)benzofuran)3yl)Nhexadecylacetamide
2((2S6R)7chloro46dimethoxy2(4methoxyphenyl)6methyl34dioxo67dihydro3H4H25spirobi(benzofuran)3yl)Nhexadecylacetamide
2((2S6R)7chloro46dimethoxy2(4methoxyphenyl)6methyl34dioxospiro(1benzofuran2567dihydro1benzofuran)3yl)Nhexadecylacetamide
CCCCCCCCCCCCCCCCNC(=O)Cc1c(oc2c1C(=O)(C@)1((C@@H)(C2)C)Oc2c(C1=O)c(OC)cc(c2Cl)OC)c1ccc(cc1)OC
InChI=1SC43H56ClNO8c1678910111213141516171819244535(46)26313633(5239(31)29202230(493)232129)2528(2)43(41(36)47)42(48)3732(504)2734(515)38(44)40(37)5343h20232728H6192426H215H3(H4546)t2843+m1s1
MFCD32651136
ZINC001848443534
Check stock
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Check stock on Vitas-MAvailable files
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