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4-[(1E)-2-(acetylamino)-3-({4-[4-(2-{4-[4-({(2Z)-2-(acetylamino)-3-[4-(acetyloxy)phenyl]prop-2-enoyl}amino)phenoxy]phenyl}propan-2-yl)phenoxy]phenyl}amino)-3-oxoprop-1-en-1-yl]phenyl acetate

Catalog ID
STK668747
SMILES O=C(/C(=C/c1ccc(cc1)OC(=O)C)/NC(=O)C)Nc1ccc(cc1)Oc1ccc(cc1)C(c1ccc(cc1)Oc1ccc(cc1)NC(=O)/C(=C\c1ccc(cc1)OC(=O)C)/NC(=O)C)(C)C

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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 C53H48N4O10 MW 900.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C53H48N4O10/c1-33(58)54-49(31-37-7-19-43(20-8-37)64-35(3)60)51(62)56-41-15-27-47(28-16-41)66-45-23-11-39(12-24-45)53(5,6)40-13-25-46(26-14-40)67-48-29-17-42(18-30-48)57-52(63)50(55-34(2)59)32-38-9-21-44(22-10-38)65-36(4)61/h7-32H,1-6H3,(H,54,58)(
InChIKey
ZRUBLWKBAXCCMC-ZXWAIDDWSA-N
Synonyms

(4((Z)2ACETAMIDO3(4(4(2(4(4(((E)2ACETAMIDO3(4ACETYLOXYPHENYL)PROP2ENOYL)AMINO)PHENOXY)PHENYL)PROPAN2YL)PHENOXY)ANILINO)3OXOPROP1ENYL)PHENYL)ACETATE
4((1E)2(acetylamino)3((4(4(2(4(4(((2Z)2(acetylamino)3(4(acetyloxy)phenyl)prop2enoyl)amino)phenoxy)phenyl)propan2yl)phenoxy)phenyl)amino)3oxoprop1en1yl)phenylacetate
CC(=O)NC(=CC1=CC=C(C=C1)OC(=O)C)C(=O)NC2=CC=C(C=C2)OC3=CC=C(C=C3)C(C)(C)C4=CC=C(C=C4)OC5=CC=C(C=C5)NC(=O)C(=CC6=CC=C(C=C6)OC(=O)C)NC(=O)C
InChI=1SC53H48N4O10c133(58)5449(313771943(20837)6435(3)60)51(62)5641152747(281641)6645231139(122445)53(56)40132546(261440)6748291742(183048)5752(63)50(5534(2)59)323892144(221038)6536(4)61h732H16H3(H5458)(H5559)(H5662)(H5763)b49315032+
MFCD00732928
O=C(C(=Cc1ccc(cc1)OC(=O)C)NC(=O)C)Nc1ccc(cc1)Oc1ccc(cc1)C(c1ccc(cc1)Oc1ccc(cc1)NC(=O)C(=Cc1ccc(cc1)OC(=O)C)NC(=O)C)(C)C
ZINC000150347360
ZINC150347360

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Available files

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