Vitas-M small molecule compound
(4aR)-8-acetyl-5,7-dihydroxy-1-(2-hydroxyethyl)-3,4a,6-trimethyl-1,4a-dihydro-4H-[1]benzofuro[3,2-f]indazol-4-one
Catalog ID
STL551637
SMILES OCCn1nc(c2c1C=C1Oc3c([C@]1(C2=O)C)c(O)c(c(c3C(=O)C)O)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 C20H20N2O6 MW 384.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N2O6/c1-8-16(25)14(10(3)24)18-15(17(8)26)20(4)12(28-18)7-11-13(19(20)27)9(2)21-22(11)5-6-23/h7,23,25-26H,5-6H2,1-4H3/t20-/m0/s1InChIKey
NRLJGWJKQJYEGM-FQEVSTJZSA-NSynonyms
(4~(a)~(R))8acetyl57dihydroxy1(2hydroxyethyl)34~(a)6trimethyl(1)benzofuro(32f)indazol4one
(4aR)8acetyl57dihydroxy1(2hydroxyethyl)34a6trimethyl14adihydro4H(1)benzofuro(32f)indazol4one
(R)8acetyl57dihydroxy1(2hydroxyethyl)34a6trimethyl1Hbenzofuro(32f)indazol4(4aH)one
135640000
InChI=1SC20H20N2O6c1816(25)14(10(3)24)1815(17(8)26)20(4)12(2818)71113(19(20)27)9(2)2122(11)5623h7232526H56H214H3t20m0s1
OCCn1nc(c2c1C=C1Oc3c((C@)1(C2=O)C)c(O)c(c(c3C(=O)C)O)C)C
ZINC001547138592
Check stock
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