Vitas-M small molecule compound
(2E,9bR)-6-acetyl-7,9-dihydroxy-8,9b-dimethyl-2-(1-{[5-([1,2,4]triazolo[4,3-a]pyridin-3-yl)pentyl]amino}ethylidene)dibenzo[b,d]furan-1,3(2H,9bH)-dione
Catalog ID
STL548550
SMILES C/C(=C\1/C(=O)C=C2[C@@](C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)/NCCCCCc1nnc2n1cccc2
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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 C29H30N4O6 MW 530.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30N4O6/c1-15-25(36)23(17(3)34)27-24(26(15)37)29(4)19(39-27)14-18(35)22(28(29)38)16(2)30-12-8-5-6-10-20-31-32-21-11-7-9-13-33(20)21/h7,9,11,13-14,30,36-37H,5-6,8,10,12H2,1-4H3/b22-16+/t29-/m0/s1InChIKey
NLSZZIPPWFRRQB-JROZDVGBSA-NSynonyms
(2~(E)9~(b)~(R))6acetyl79dihydroxy89~(b)dimethyl2(1(5((124)triazolo(43a)pyridin3yl)pentylamino)ethylidene)dibenzofuran13dione
(2E9bR)6acetyl79dihydroxy89bdimethyl2(1((5((124)triazolo(43a)pyridin3yl)pentyl)amino)ethylidene)dibenzo(bd)furan13(2H9bH)dione
(RE)2(1((5((124)triazolo(43a)pyridin3yl)pentyl)amino)ethylidene)6acetyl79dihydroxy89bdimethyldibenzo(bd)furan13(2H9bH)dione
110206584
CC(=C1C(=O)C=C2(C@@)(C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)NCCCCCc1nnc2n1cccc2
InChI=1SC29H30N4O6c11525(36)23(17(3)34)2724(26(15)37)29(4)19(3927)1418(35)22(28(29)38)16(2)3012856102031322111791333(20)21h79111314303637H5681012H214H3b2216+t29m0s1
ZINC000253410584
ZINC253410584
Check stock
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