Vitas-M small molecule compound
1-[({[(3Z,8xi,9xi,14xi)-17-hydroxyandrost-4-en-3-ylidene]amino}oxy)acetyl]proline
Catalog ID
STL525275
SMILES OC(=O)C1CCCN1C(=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 C26H38N2O5 MW 458.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H38N2O5/c1-25-11-9-17(27-33-15-23(30)28-13-3-4-21(28)24(31)32)14-16(25)5-6-18-19-7-8-22(29)26(19,2)12-10-20(18)25/h14,18-22,29H,3-13,15H2,1-2H3,(H,31,32)/b27-17-/t18?,19?,20?,21?,22?,25-,26-/m0/s1InChIKey
QEYAEUZKMOAMQZ-YDHINZBRSA-NSynonyms
1(((((3Z8xi9xi14xi)17hydroxyandrost4en3ylidene)amino)oxy)acetyl)proline
1(2((((10R13S)17hydroxy1013dimethyl78911121314151617decahydro1Hcyclopenta(a)phenanthren3(2H6H10H)ylidene)amino)oxy)acetyl)pyrrolidine2carboxylicacid
1(2((~(Z))((10~(R)13~(S))17hydroxy1013dimethyl126789111214151617dodecahydrocyclopenta(a)phenanthren3ylidene)amino)oxyacetyl)pyrrolidine2carboxylicacid
16396650
InChI=1SC26H38N2O5c12511917(27331523(30)28133421(28)24(31)32)1416(25)5618197822(29)26(192)121020(18)25h14182229H31315H212H3(H3132)b2717t18?19?20?21?22?2526m0s1
MFCD02057427
OC(=O)C1CCCN1C(=O)CON=C1CC(C@)2(C(=C1)CCC1C2CC(C@)2(C1CCC2O)C)C
ZINC000012659021
ZINC000257372870
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