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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-(3-hydroxypropyl)propanamide

Catalog ID
STL552020
SMILES OCCCNC(=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 C29H32ClNO10 MW 590.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H32ClNO10/c1-14-10-18(34)23(16(12-22(35)31-8-5-9-32)15-6-7-17(33)19(11-15)38-2)27(36)29(14)28(37)24-20(39-3)13-21(40-4)25(30)26(24)41-29/h6-7,11,13-14,16,32-33,36H,5,8-10,12H2,1-4H3,(H,31,35)/t14-,16?,29+/m1/s1
InChIKey
YCOPRUMUWGTJRS-GWIRAREPSA-N
Synonyms

132352118
3((1S6R)7chloro2hydroxy46dimethoxy6methyl34dioxo3Hspiro(benzofuran21cyclohex(2)en)3yl)3(4hydroxy3methoxyphenyl)N(3hydroxypropyl)propanamide
3((2~(S)4~(R))7chloro2hydroxy46dimethoxy4methyl36dioxospiro(1benzofuran23cyclohexene)1yl)3(4hydroxy3methoxyphenyl)~(N)(3hydroxypropyl)propanamide
3((2S6R)7chloro2hydroxy46dimethoxy6methyl34dioxo3Hspiro(1benzofuran21cyclohex(2)en)3yl)3(4hydroxy3methoxyphenyl)N(3hydroxypropyl)propanamide
InChI=1SC29H32ClNO10c1141018(34)23(16(1222(35)3185932)156717(33)19(1115)382)27(36)29(14)28(37)2420(393)1321(404)25(30)26(24)4129h6711131416323336H581012H214H3(H3135)t1416?29+m1s1
OCCCNC(=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
ZINC000828754127
ZINC000828754137

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.

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