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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-hydroxy-2-(4-hydroxyphenyl)ethyl]-3-(4-hydroxy-3-methoxyphenyl)propanamide

Catalog ID
STL551912
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(c1ccc(cc1)O)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 C34H34ClNO11 MW 668.10 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H34ClNO11/c1-16-11-22(39)28(32(42)34(16)33(43)29-25(45-3)14-26(46-4)30(35)31(29)47-34)20(18-7-10-21(38)24(12-18)44-2)13-27(41)36-15-23(40)17-5-8-19(37)9-6-17/h5-10,12,14,16,20,23,37-38,40,42H,11,13,15H2,1-4H3,(H,36,41)/t16-,20?,23?,34+/m1/s1
InChIKey
DTNGHEHMXTXDSQ-GHHGBZPRSA-N
Synonyms

132352092
3((1S6R)7chloro2hydroxy46dimethoxy6methyl34dioxo3Hspiro(benzofuran21cyclohex(2)en)3yl)N(2hydroxy2(4hydroxyphenyl)ethyl)3(4hydroxy3methoxyphenyl)propanamide
3((2~(S)4~(R))7chloro2hydroxy46dimethoxy4methyl36dioxospiro(1benzofuran23cyclohexene)1yl)~(N)(2hydroxy2(4hydroxyphenyl)ethyl)3(4hydroxy3methoxyphenyl)propanamide
3((2S6R)7chloro2hydroxy46dimethoxy6methyl34dioxo3Hspiro(1benzofuran21cyclohex(2)en)3yl)N(2hydroxy2(4hydroxyphenyl)ethyl)3(4hydroxy3methoxyphenyl)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(c1ccc(cc1)O)O
InChI=1SC34H34ClNO11c1161122(39)28(32(42)34(16)33(43)2925(453)1426(464)30(35)31(29)4734)20(1871021(38)24(1218)442)1327(41)361523(40)175819(37)9617h510121416202337384042H111315H214H3(H3641)t1620?23?34+m1s1
ZINC000824595833
ZINC000824595836

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Available files

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