Vitas-M small molecule compound
N-(4-oxo-4-{[(8xi,9xi,14xi)-3-oxoandrost-4-en-17-yl]oxy}butanoyl)alanylnorvaline
Catalog ID
STL524379
SMILES CCCC(C(=O)O)NC(=O)C(NC(=O)CCC(=O)OC1CCC2[C@]1(C)CCC1C2CCC2=CC(=O)CC[C@]12C)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 C31H46N2O7 MW 558.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H46N2O7/c1-5-6-24(29(38)39)33-28(37)18(2)32-26(35)11-12-27(36)40-25-10-9-22-21-8-7-19-17-20(34)13-15-30(19,3)23(21)14-16-31(22,25)4/h17-18,21-25H,5-16H2,1-4H3,(H,32,35)(H,33,37)(H,38,39)/t18?,21?,22?,23?,24?,25?,30-,31-/m0/s1InChIKey
MOQBXSZFXHLQET-WNRFZVOYSA-NSynonyms
2(2((4(((10~(R)13~(S))1013dimethyl3oxo126789111214151617dodecahydrocyclopenta(a)phenanthren17yl)oxy)4oxobutanoyl)amino)propanoylamino)pentanoicacid
2(2(4(((8R9S10R13S14S)1013dimethyl3oxo2367891011121314151617tetradecahydro1Hcyclopenta(a)phenanthren17yl)oxy)4oxobutanamido)propanamido)pentanoicacid
44664618
CCCC(C(=O)O)NC(=O)C(NC(=O)CCC(=O)OC1CC(C@@H)2(C@)1(C)CC(C@H)1(C@H)2CCC2=CC(=O)CC(C@)12C)C
InChI=1SC31H46N2O7c15624(29(38)39)3328(37)18(2)3226(35)111227(36)4025109222187191720(34)131530(193)23(21)141631(2225)4h17182125H516H214H3(H3235)(H3337)(H3839)t18?21?22?23?24?25?3031m0s1
MFCD02115228
N(4oxo4(((8xi9xi14xi)3oxoandrost4en17yl)oxy)butanoyl)alanylnorvaline
ZINC000253502591
ZINC000253502600
Check stock
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Check stock on Vitas-MAvailable files
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