Vitas-M small molecule compound
{4-[7-chloro-5'-hydroxy-4,6-dimethoxy-3'-(methoxycarbonyl)-2',7'-dimethyl-3-oxo-7',8'-dihydro-3H,4'H-spiro[1-benzofuran-2,6'-quinolin]-4'-yl]phenoxy}acetic acid
Catalog ID
STL549776
SMILES COC(=O)C1=C(C)N=C2C(=C(O)C3(C(C2)C)Oc2c(C3=O)c(OC)cc(c2Cl)OC)C1c1ccc(cc1)OCC(=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 C30H28ClNO10 MW 598.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28ClNO10/c1-13-10-17-23(27(35)30(13)28(36)24-18(38-3)11-19(39-4)25(31)26(24)42-30)22(21(14(2)32-17)29(37)40-5)15-6-8-16(9-7-15)41-12-20(33)34/h6-9,11,13,22,35H,10,12H2,1-5H3,(H,33,34)InChIKey
RIYDMDFDDOOHGU-UHFFFAOYSA-NSynonyms
(4(7chloro5hydroxy46dimethoxy3(methoxycarbonyl)27dimethyl3oxo78dihydro3H4Hspiro(1benzofuran26quinolin)4yl)phenoxy)aceticacid
InChI=1SC30H28ClNO10c113101723(27(35)30(13)28(36)2418(383)1119(394)25(31)26(24)4230)22(21(14(2)3217)29(37)405)156816(9715)411220(33)34h6911132235H1012H215H3(H3334)
MFCD31757198
ZINC000888089267
ZINC000888089270
Check stock
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Check stock on Vitas-MAvailable files
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