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3-[(2S,6'R)-7-chloro-2'-hydroxy-4,6-dimethoxy-6'-methyl-3,4'-dioxo-3H-spiro[1-benzofuran-2,1'-cyclohex[2]en]-3'-yl]-3-(4-hydroxy-3-methoxyphenyl)-N-(pyridin-2-ylmethyl)propanamide

Catalog ID
STL552123
SMILES COc1cc(ccc1O)C(C1=C(O)[C@]2([C@@H](CC1=O)C)Oc1c(C2=O)c(OC)cc(c1Cl)OC)CC(=O)NCc1ccccn1

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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 C32H31ClN2O9 MW 623.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H31ClN2O9/c1-16-11-21(37)26(30(39)32(16)31(40)27-23(42-3)14-24(43-4)28(33)29(27)44-32)19(17-8-9-20(36)22(12-17)41-2)13-25(38)35-15-18-7-5-6-10-34-18/h5-10,12,14,16,19,36,39H,11,13,15H2,1-4H3,(H,35,38)/t16-,19?,32+/m1/s1
InChIKey
ZUFNPIJHMAWYGZ-UBOAEFFUSA-N
Synonyms

132352021
3((1S6R)7chloro2hydroxy46dimethoxy6methyl34dioxo3Hspiro(benzofuran21cyclohex(2)en)3yl)3(4hydroxy3methoxyphenyl)N(pyridin2ylmethyl)propanamide
3((2~(S)4~(R))7chloro2hydroxy46dimethoxy4methyl36dioxospiro(1benzofuran23cyclohexene)1yl)3(4hydroxy3methoxyphenyl)~(N)(pyridin2ylmethyl)propanamide
3((2S6R)7chloro2hydroxy46dimethoxy6methyl34dioxo3Hspiro(1benzofuran21cyclohex(2)en)3yl)3(4hydroxy3methoxyphenyl)N(pyridin2ylmethyl)propanamide
COc1cc(ccc1O)C(C1=C(O)(C@)2((C@@H)(CC1=O)C)Oc1c(C2=O)c(OC)cc(c1Cl)OC)CC(=O)NCc1ccccn1
InChI=1SC32H31ClN2O9c1161121(37)26(30(39)32(16)31(40)2723(423)1424(434)28(33)29(27)4432)19(178920(36)22(1217)412)1325(38)351518756103418h510121416193639H111315H214H3(H3538)t1619?32+m1s1
ZINC000824596595
ZINC000824596598

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Available files

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