Vitas-M small molecule compound
methyl N-[({[(3E,8xi,9xi,14xi)-17-hydroxyandrost-4-en-3-ylidene]amino}oxy)acetyl]tryptophanate
Catalog ID
STL525093
SMILES COC(=O)C(Cc1c[nH]c2c1cccc2)NC(=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 C33H43N3O5 MW 561.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H43N3O5/c1-32-14-12-22(17-21(32)8-9-24-25-10-11-29(37)33(25,2)15-13-26(24)32)36-41-19-30(38)35-28(31(39)40-3)16-20-18-34-27-7-5-4-6-23(20)27/h4-7,17-18,24-26,28-29,34,37H,8-16,19H2,1-3H3,(H,35,38)/b36-22+/t24?,25?,26?,28?,29?,32-,33-/m0/s1InChIKey
NPJVQQMSVNRXBF-UNTHYVIYSA-NSynonyms
135639017
COC(=O)C(Cc1c(nH)c2c1cccc2)NC(=O)CON=C1CC(C@)2(C(=C1)CC(C@@H)1(C@@H)2CC(C@)2((C@H)1CC(C@H)2O)C)C
InChI=1SC33H43N3O5c132141222(1721(32)892425101129(37)33(252)151326(24)32)36411930(38)3528(31(39)403)1620183427754623(20)27h471718242628293437H81619H213H3(H3538)b3622+t24?25?26?28?29?3233m0s1
methyl2((2((~(E))((10~(R)13~(S))17hydroxy1013dimethyl126789111214151617dodecahydrocyclopenta(a)phenanthren3ylidene)amino)oxyacetyl)amino)3(1~(H)indol3yl)propanoate
methyl2(2(((E)((8R9S10R13S14S17R)17hydroxy1013dimethyl78911121314151617decahydro1Hcyclopenta(a)phenanthren3(2H6H10H)ylidene)amino)oxy)acetamido)3(1Hindol3yl)propanoate
methylN(((((3E8xi9xi14xi)17hydroxyandrost4en3ylidene)amino)oxy)acetyl)tryptophanate
MFCD02059615
ZINC001772491621
ZINC001772491624
Check stock
See real-time availability and sample size for STL525093 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
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