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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-[2-oxo-2-(pyridin-2-ylamino)ethyl]propanamide

Catalog ID
STL551883
SMILES COc1cc(ccc1O)C(C1=C(O)[C@]2([C@@H](CC1=O)C)Oc1c(C2=O)c(OC)cc(c1Cl)OC)CC(=O)NCC(=O)Nc1ccccn1

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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 C33H32ClN3O10 MW 666.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H32ClN3O10/c1-16-11-20(39)27(31(42)33(16)32(43)28-22(45-3)14-23(46-4)29(34)30(28)47-33)18(17-8-9-19(38)21(12-17)44-2)13-25(40)36-15-26(41)37-24-7-5-6-10-35-24/h5-10,12,14,16,18,38,42H,11,13,15H2,1-4H3,(H,36,40)(H,35,37,41)/t16-,18?,33+/m1/s1
InChIKey
DOGLAAOWWKDPGY-GPRWSHGWSA-N
Synonyms

132351883
3((1S6R)7chloro2hydroxy46dimethoxy6methyl34dioxo3Hspiro(benzofuran21cyclohex(2)en)3yl)3(4hydroxy3methoxyphenyl)N(2oxo2(pyridin2ylamino)ethyl)propanamide
3((2~(S)4~(R))7chloro2hydroxy46dimethoxy4methyl36dioxospiro(1benzofuran23cyclohexene)1yl)3(4hydroxy3methoxyphenyl)~(N)(2oxo2(pyridin2ylamino)ethyl)propanamide
3((2S6R)7chloro2hydroxy46dimethoxy6methyl34dioxo3Hspiro(1benzofuran21cyclohex(2)en)3yl)3(4hydroxy3methoxyphenyl)N(2oxo2(pyridin2ylamino)ethyl)propanamide
COc1cc(ccc1O)C(C1=C(O)(C@)2((C@@H)(CC1=O)C)Oc1c(C2=O)c(OC)cc(c1Cl)OC)CC(=O)NCC(=O)Nc1ccccn1
InChI=1SC33H32ClN3O10c1161120(39)27(31(42)33(16)32(43)2822(453)1423(464)29(34)30(28)4733)18(178919(38)21(1217)442)1325(40)361526(41)3724756103524h510121416183842H111315H214H3(H3640)(H353741)t1618?33+m1s1
ZINC000824595830
ZINC000824595831

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Available files

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