Vitas-M small molecule compound
(4S,8S,9S,9bS)-9-(chloromethyl)-8,9-dihydroxy-3,6-dimethylidene-2-oxododecahydroazuleno[4,5-b]furan-4-yl 3-chloro-2-hydroxy-2-methylpropanoate
Catalog ID
STL564419
SMILES ClC[C@@]1(O)[C@@H](O)CC2C1[C@H]1OC(=O)C(=C)C1[C@H](CC2=C)OC(=O)C(CCl)(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 C19H24Cl2O7 MW 435.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H24Cl2O7/c1-8-4-11(27-17(24)18(3,25)6-20)13-9(2)16(23)28-15(13)14-10(8)5-12(22)19(14,26)7-21/h10-15,22,25-26H,1-2,4-7H2,3H3/t10?,11-,12-,13?,14?,15-,18?,19+/m0/s1InChIKey
NUVAJKJDTZTFLK-VIAULTQHSA-NSynonyms
((4S8S9S9bS)9(chloromethyl)89dihydroxy36dimethylidene2oxo3a456a789a9boctahydroazuleno(45b)furan4yl)3chloro2hydroxy2methylpropanoate
(4R8R9R9bS)9(chloromethyl)89dihydroxy36dimethylene2oxododecahydroazuleno(45b)furan4yl3chloro2hydroxy2methylpropanoate
(4S8S9S9bS)9(chloromethyl)89dihydroxy36dimethylidene2oxododecahydroazuleno(45b)furan4yl3chloro2hydroxy2methylpropanoate
24867659
ClC(C@)1(O)(C@H)(O)CC2C1(C@H)1OC(=O)C(=C)C1(C@@H)(CC2=C)OC(=O)C(CCl)(O)C
InChI=1SC19H24Cl2O7c18411(2717(24)18(325)620)139(2)16(23)2815(13)1410(8)512(22)19(1426)721h1015222526H1247H23H3t10?111213?14?1518?19+m0s1
MFCD32651464
ZINC000017654129
ZINC000253917816
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