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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]-N-[2-(1H-indol-3-yl)ethyl]-3-(3,4,5-trimethoxyphenyl)propanamide

Catalog ID
STL561703
SMILES COc1cc(cc(c1OC)OC)C(C1=C(O)[C@]2([C@@H](CC1=O)C)Oc1c(C2=O)c(OC)cc(c1Cl)OC)CC(=O)NCCc1c[nH]c2c1cccc2

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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 C38H39ClN2O10 MW 719.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H39ClN2O10/c1-19-13-25(42)31(36(44)38(19)37(45)32-26(46-2)17-27(47-3)33(39)35(32)51-38)23(21-14-28(48-4)34(50-6)29(15-21)49-5)16-30(43)40-12-11-20-18-41-24-10-8-7-9-22(20)24/h7-10,14-15,17-19,23,41,44H,11-13,16H2,1-6H3,(H,40,43)/t19-,23?,38+/m
InChIKey
UDUQNEZNCXPBSZ-CBZVNVCHSA-N
Synonyms

145705059
3((2S4R)7chloro2hydroxy46dimethoxy4methyl36dioxospiro(1benzofuran23cyclohexene)1yl)N(2(1Hindol3yl)ethyl)3(345trimethoxyphenyl)propanamide
3((2S6R)7chloro2hydroxy46dimethoxy6methyl34dioxo3Hspiro(1benzofuran21cyclohex(2)en)3yl)N(2(1Hindol3yl)ethyl)3(345trimethoxyphenyl)propanamide
COc1cc(cc(c1OC)OC)C(C1=C(O)(C@)2((C@@H)(CC1=O)C)Oc1c(C2=O)c(OC)cc(c1Cl)OC)CC(=O)NCCc1c(nH)c2c1cccc2
InChI=1SC38H39ClN2O10c1191325(42)31(36(44)38(19)37(45)3226(462)1727(473)33(39)35(32)5138)23(211428(484)34(506)29(1521)495)1630(43)401211201841241087922(20)24h71014151719234144H111316H216H3(H4043)t1923?38+m1s1
MFCD32650768
N(2(1Hindol3yl)ethyl)3((1S6R)7chloro2hydroxy46dimethoxy6methyl34dioxo3Hspiro(benzofuran21cyclohex(2)en)3yl)3(345trimethoxyphenyl)propanamide
ZINC001848443054
ZINC001848443055

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Available files

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