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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-[(2-methoxyethyl)amino]-2-oxoethyl}propanamide

Catalog ID
STL551561
SMILES COCCNC(=O)CNC(=O)CC(C1=C(O)[C@]2([C@@H](CC1=O)C)Oc1c(C2=O)c(OC)cc(c1Cl)OC)c1ccc(c(c1)OC)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 C31H35ClN2O11 MW 647.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H35ClN2O11/c1-15-10-19(36)25(29(39)31(15)30(40)26-21(43-4)13-22(44-5)27(32)28(26)45-31)17(16-6-7-18(35)20(11-16)42-3)12-23(37)34-14-24(38)33-8-9-41-2/h6-7,11,13,15,17,35,39H,8-10,12,14H2,1-5H3,(H,33,38)(H,34,37)/t15-,17?,31+/m1/s1
InChIKey
JVPMANKVFIPERK-IWJPMEPFSA-N
Synonyms

132352501
3((1S6R)7chloro2hydroxy46dimethoxy6methyl34dioxo3Hspiro(benzofuran21cyclohex(2)en)3yl)3(4hydroxy3methoxyphenyl)N(2((2methoxyethyl)amino)2oxoethyl)propanamide
3((2~(S)4~(R))7chloro2hydroxy46dimethoxy4methyl36dioxospiro(1benzofuran23cyclohexene)1yl)3(4hydroxy3methoxyphenyl)~(N)(2(2methoxyethylamino)2oxoethyl)propanamide
3((2S6R)7chloro2hydroxy46dimethoxy6methyl34dioxo3Hspiro(1benzofuran21cyclohex(2)en)3yl)3(4hydroxy3methoxyphenyl)N(2((2methoxyethyl)amino)2oxoethyl)propanamide
COCCNC(=O)CNC(=O)CC(C1=C(O)(C@)2((C@@H)(CC1=O)C)Oc1c(C2=O)c(OC)cc(c1Cl)OC)c1ccc(c(c1)OC)O
InChI=1SC31H35ClN2O11c1151019(36)25(29(39)31(15)30(40)2621(434)1322(445)27(32)28(26)4531)17(166718(35)20(1116)423)1223(37)341424(38)3389412h67111315173539H8101214H215H3(H3338)(H3437)t1517?31+m1s1
ZINC000824419888
ZINC000824419893

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Available files

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