Vitas-M small molecule compound
N-[({[(3E,8xi,9xi,14xi)-17-hydroxyandrost-4-en-3-ylidene]amino}oxy)acetyl]glutamic acid
Catalog ID
STL537466
SMILES O=C(NC(C(=O)O)CCC(=O)O)CO/N=C/1\CC[C@]2(C(=C1)CCC1C2CC[C@]2(C1CCC2O)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 C26H38N2O7 MW 490.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H38N2O7/c1-25-11-9-16(28-35-14-22(30)27-20(24(33)34)6-8-23(31)32)13-15(25)3-4-17-18-5-7-21(29)26(18,2)12-10-19(17)25/h13,17-21,29H,3-12,14H2,1-2H3,(H,27,30)(H,31,32)(H,33,34)/b28-16+/t17?,18?,19?,20?,21?,25-,26-/m0/s1InChIKey
BKULYGKWNYMZML-QIXJCXRCSA-NSynonyms
16399494
2((2((~(E))((10~(R)13~(S))17hydroxy1013dimethyl126789111214151617dodecahydrocyclopenta(a)phenanthren3ylidene)amino)oxyacetyl)amino)pentanedioicacid
2(2((((10R13S)17hydroxy1013dimethyl78911121314151617decahydro1Hcyclopenta(a)phenanthren3(2H6H10H)ylidene)amino)oxy)acetamido)pentanedioicacid
InChI=1SC26H38N2O7c12511916(28351422(30)2720(24(33)34)6823(31)32)1315(25)3417185721(29)26(182)121019(17)25h13172129H31214H212H3(H2730)(H3132)(H3334)b2816+t17?18?19?20?21?2526m0s1
MFCD04144012
N(((((3E8xi9xi14xi)17hydroxyandrost4en3ylidene)amino)oxy)acetyl)glutamicacid
O=C(NC(C(=O)O)CCC(=O)O)CON=C1CC(C@)2(C(=C1)CCC1C2CC(C@)2(C1CCC2O)C)C
ZINC000257372727
ZINC000257372730
Check stock
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Check stock on Vitas-MAvailable files
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