Vitas-M small molecule compound
(19E)-3,5,14-trihydroxy-19-(hydroxyimino)card-20(22)-enolide
Catalog ID
STL372876
SMILES O/N=C/C12CCC(CC2(O)CCC2C1CCC1(C2(O)CCC1C1=CC(=O)OC1)C)O
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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 C23H33NO6 MW 419.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H33NO6/c1-20-6-3-17-18(23(20,28)9-5-16(20)14-10-19(26)30-12-14)4-8-22(27)11-15(25)2-7-21(17,22)13-24-29/h10,13,15-18,25,27-29H,2-9,11-12H2,1H3/b24-13+InChIKey
PGQOWJBTWKJAQR-ZMOGYAJESA-NSynonyms
(19E)3514trihydroxy19(hydroxyimino)card20(22)enolide
(E)3514trihydroxy13methyl17(5oxo25dihydrofuran3yl)hexadecahydro1Hcyclopenta(a)phenanthrene10carbaldehydeoxime
3(3514trihydroxy10((E)hydroxyiminomethyl)13methyl23467891112151617dodecahydro1Hcyclopenta(a)phenanthren17yl)2Hfuran5one
CC12CCC3C(C1(CCC2C4=CC(=O)OC4)O)CCC5(C3(CCC(C5)O)C=NO)O
InChI=1SC23H33NO6c120631718(23(2028)9516(20)141019(26)301214)4822(27)1115(25)2721(1722)132429h10131518252729H291112H21H3b2413+
MFCD00596991
ON=C(C@@)12CC(C@@H)(C(C@@)2(O)CC(C@@H)2(C@@H)1CC(C@)1((C@)2(O)CC(C@@H)1C1=CC(=O)OC1)C)O
ON=CC12CCC(CC2(O)CCC2C1CCC1(C2(O)CCC1C1=CC(=O)OC1)C)O
ZINC000253527885
ZINC000253527894
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