Vitas-M small molecule compound

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

Catalog ID
STL546900
SMILES Clc1ccc2c(c1)n(CCCN/C(=C/1\C(=O)C=C3[C@@](C1=O)(C)c1c(O)c(C)c(c(c1O3)C(=O)C)O)/C)cc2

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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 C29H27ClN2O6 MW 535.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27ClN2O6/c1-14-25(35)23(16(3)33)27-24(26(14)36)29(4)21(38-27)13-20(34)22(28(29)37)15(2)31-9-5-10-32-11-8-17-6-7-18(30)12-19(17)32/h6-8,11-13,31,35-36H,5,9-10H2,1-4H3/b22-15+/t29-/m0/s1
InChIKey
ORFKSDKPNGNEGI-NKVKBKOUSA-N
Synonyms

(2~(E)9~(b)~(R))6acetyl2(1(3(6chloroindol1yl)propylamino)ethylidene)79dihydroxy89~(b)dimethyldibenzofuran13dione
(2E9bR)6acetyl2(1((3(6chloro1Hindol1yl)propyl)amino)ethylidene)79dihydroxy89bdimethyldibenzo(bd)furan13(2H9bH)dione
(RE)6acetyl2(1((3(6chloro1Hindol1yl)propyl)amino)ethylidene)79dihydroxy89bdimethyldibenzo(bd)furan13(2H9bH)dione
110207263
Clc1ccc2c(c1)n(CCCNC(=C1C(=O)C=C3(C@@)(C1=O)(C)c1c(O)c(C)c(c(c1O3)C(=O)C)O)C)cc2
InChI=1SC29H27ClN2O6c11425(35)23(16(3)33)2724(26(14)36)29(4)21(3827)1320(34)22(28(29)37)15(2)31951032118176718(30)1219(17)32h681113313536H5910H214H3b2215+t29m0s1
ZINC000253411494
ZINC253411494

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Available files

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