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

Catalog ID
STL550070
SMILES OC1CS(=O)(=O)CC1Nc1ccc(cc1)N/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 C28H28N2O9S MW 568.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N2O9S/c1-12-24(34)22(14(3)31)26-23(25(12)35)28(4)20(39-26)9-18(32)21(27(28)36)13(2)29-15-5-7-16(8-6-15)30-17-10-40(37,38)11-19(17)33/h5-9,17,19,29-30,33-35H,10-11H2,1-4H3/b21-13+/t17?,19?,28-/m0/s1
InChIKey
KEJSKMPEMGMZDC-GJUCOINLSA-N
Synonyms

(2~(E)9~(b)~(R))6acetyl79dihydroxy2(1(4((4hydroxy11dioxothiolan3yl)amino)anilino)ethylidene)89~(b)dimethyldibenzofuran13dione
(2E9bR)6acetyl79dihydroxy2(1((4((4hydroxy11dioxidotetrahydrothiophen3yl)amino)phenyl)amino)ethylidene)89bdimethyldibenzo(bd)furan13(2H9bH)dione
(9bRE)6acetyl79dihydroxy2(1((4((4hydroxy11dioxidotetrahydrothiophen3yl)amino)phenyl)amino)ethylidene)89bdimethyldibenzo(bd)furan13(2H9bH)dione
132352278
InChI=1SC28H28N2O9Sc11224(34)22(14(3)31)2623(25(12)35)28(4)20(3926)918(32)21(27(28)36)13(2)29155716(8615)30171040(3738)1119(17)33h59171929303335H1011H214H3b2113+t17?19?28m0s1
OC1CS(=O)(=O)CC1Nc1ccc(cc1)NC(=C1C(=O)C=C2(C@@)(C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)C
ZINC000828644027
ZINC000828644030

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Available files

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