Vitas-M small molecule compound
N-(4-oxo-4-{[(8xi,9xi,14xi)-3-oxoandrost-4-en-17-yl]oxy}butanoyl)alanylnorleucine
Catalog ID
STL525799
SMILES CCCCC(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 C32H48N2O7 MW 572.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H48N2O7/c1-5-6-7-25(30(39)40)34-29(38)19(2)33-27(36)12-13-28(37)41-26-11-10-23-22-9-8-20-18-21(35)14-16-31(20,3)24(22)15-17-32(23,26)4/h18-19,22-26H,5-17H2,1-4H3,(H,33,36)(H,34,38)(H,39,40)/t19?,22?,23?,24?,25?,26?,31-,32-/m0/s1InChIKey
OFARKSZXSODUMO-KRUPMHBBSA-NSynonyms
2(2((4(((10~(R)13~(S))1013dimethyl3oxo126789111214151617dodecahydrocyclopenta(a)phenanthren17yl)oxy)4oxobutanoyl)amino)propanoylamino)hexanoicacid
2(2(4(((8R9S10R13S14S)1013dimethyl3oxo2367891011121314151617tetradecahydro1Hcyclopenta(a)phenanthren17yl)oxy)4oxobutanamido)propanamido)hexanoicacid
44664607
CCCCC(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=1SC32H48N2O7c156725(30(39)40)3429(38)19(2)3327(36)121328(37)41261110232298201821(35)141631(203)24(22)151732(2326)4h18192226H517H214H3(H3336)(H3438)(H3940)t19?22?23?24?25?26?3132m0s1
MFCD02114916
N(4oxo4(((8xi9xi14xi)3oxoandrost4en17yl)oxy)butanoyl)alanylnorleucine
ZINC000253502678
ZINC000253502686
Check stock
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Check stock on Vitas-MAvailable files
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