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(2S,6'R)-7-chloro-2'-hydroxy-3'-[1-(4-hydroxy-3-methoxyphenyl)-3-oxo-3-(3,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridin-5-yl)propyl]-4,6-dimethoxy-6'-methyl-3H,4'H-spiro[1-benzofuran-2,1'-cyclohex[2]ene]-3,4'-dione

Catalog ID
STL552626
SMILES COc1cc(ccc1O)C(C1=C(O)[C@]2([C@@H](CC1=O)C)Oc1c(C2=O)c(OC)cc(c1Cl)OC)CC(=O)N1CCc2c(C1)[nH]cn2

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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 C32H32ClN3O9 MW 638.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H32ClN3O9/c1-15-9-21(38)26(30(40)32(15)31(41)27-23(43-3)12-24(44-4)28(33)29(27)45-32)17(16-5-6-20(37)22(10-16)42-2)11-25(39)36-8-7-18-19(13-36)35-14-34-18/h5-6,10,12,14-15,17,37,40H,7-9,11,13H2,1-4H3,(H,34,35)/t15-,17?,32+/m1/s1
InChIKey
PODMUDVHSASGBN-YEKWAPORSA-N
Synonyms

(1S6R)7chloro3(3(67dihydro1Himidazo(45c)pyridin5(4H)yl)1(4hydroxy3methoxyphenyl)3oxopropyl)2hydroxy46dimethoxy6methyl3Hspiro(benzofuran21cyclohex(2)ene)34dione
(2~(S)5~(R))7chloro3hydroxy2(1(4hydroxy3methoxyphenyl)3oxo3(3467tetrahydroimidazo(45c)pyridin5yl)propyl)46dimethoxy5methylspiro(1benzofuran24cyclohex2ene)13dione
(2S6R)7chloro2hydroxy3(1(4hydroxy3methoxyphenyl)3oxo3(3467tetrahydro5Himidazo(45c)pyridin5yl)propyl)46dimethoxy6methyl3H4Hspiro(1benzofuran21cyclohex(2)ene)34dione
135640829
COc1cc(ccc1O)C(C1=C(O)(C@)2((C@@H)(CC1=O)C)Oc1c(C2=O)c(OC)cc(c1Cl)OC)CC(=O)N1CCc2c(C1)nc(nH)2
InChI=1SC32H32ClN3O9c115921(38)26(30(40)32(15)31(41)2723(433)1224(444)28(33)29(27)4532)17(165620(37)22(1016)422)1125(39)36871819(1336)35143418h5610121415173740H791113H214H3(H3435)t1517?32+m1s1
ZINC001547139225
ZINC001547139228

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Available files

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