Vitas-M small molecule compound

(2E,9bR)-6-acetyl-7,9-dihydroxy-2-(1-{[2-(4-methoxyphenyl)ethyl]amino}ethylidene)-8,9b-dimethyldibenzo[b,d]furan-1,3(2H,9bH)-dione

Catalog ID
STL547414
SMILES COc1ccc(cc1)CCN/C(=C/1\C(=O)C=C2[C@@](C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)/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 C27H27NO7 MW 477.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27NO7/c1-13-23(31)21(15(3)29)25-22(24(13)32)27(4)19(35-25)12-18(30)20(26(27)33)14(2)28-11-10-16-6-8-17(34-5)9-7-16/h6-9,12,28,31-32H,10-11H2,1-5H3/b20-14+/t27-/m0/s1
InChIKey
JKXZTYRKGOYGQO-LZNHGYHVSA-N
Synonyms

(2~(E)9~(b)~(R))6acetyl79dihydroxy2(1(2(4methoxyphenyl)ethylamino)ethylidene)89~(b)dimethyldibenzofuran13dione
(2E9bR)6acetyl79dihydroxy2(1((2(4methoxyphenyl)ethyl)amino)ethylidene)89bdimethyldibenzo(bd)furan13(2H9bH)dione
(RE)6ACETYL79DIHYDROXY2(1((4METHOXYPHENETHYL)AMINO)ETHYLIDENE)89BDIMETHYLDIBENZO(BD)FURAN13(2H9BH)DIONE
110207216
COc1ccc(cc1)CCNC(=C1C(=O)C=C2(C@@)(C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)C
InChI=1SC27H27NO7c11323(31)21(15(3)29)2522(24(13)32)27(4)19(3525)1218(30)20(26(27)33)14(2)281110166817(345)9716h6912283132H1011H215H3b2014+t27m0s1
ZINC000253406988
ZINC253406988

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Available files

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