Vitas-M small molecule compound
2-({[(3Z,8xi,9xi,14xi)-17-hydroxy-20-oxopregn-4-en-3-ylidene]amino}oxy)-N-[2-(1H-indol-3-yl)ethyl]acetamide
Catalog ID
STL526946
SMILES O=C(CO/N=C\1/CC[C@]2(C(=C1)CCC1C2CC[C@]2(C1CC[C@]2(O)C(=O)C)C)C)NCCc1c[nH]c2c1cccc2
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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 C33H43N3O4 MW 545.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H43N3O4/c1-21(37)33(39)16-12-28-26-9-8-23-18-24(10-14-31(23,2)27(26)11-15-32(28,33)3)36-40-20-30(38)34-17-13-22-19-35-29-7-5-4-6-25(22)29/h4-7,18-19,26-28,35,39H,8-17,20H2,1-3H3,(H,34,38)/b36-24-/t26?,27?,28?,31-,32-,33-/m0/s1InChIKey
AMCGLWBXMGUNLP-KVIWETEISA-NSynonyms
135639210
2((((3Z8xi9xi14xi)17hydroxy20oxopregn4en3ylidene)amino)oxy)N(2(1Hindol3yl)ethyl)acetamide
2((~(Z))((10~(R)13~(S)17~(R))17acetyl17hydroxy1013dimethyl267891112141516decahydro1~(H)cyclopenta(a)phenanthren3ylidene)amino)oxy~(N)(2(1~(H)indol3yl)ethyl)acetamide
InChI=1SC33H43N3O4c121(37)33(39)1612282698231824(101431(232)27(26)111532(2833)3)36402030(38)34171322193529754625(22)29h47181926283539H81720H213H3(H3438)b3624t26?27?28?313233m0s1
MFCD03005830
N(2(1Hindol3yl)ethyl)2((((8R9S10R13S14S17R)17acetyl17hydroxy1013dimethyl78911121314151617decahydro1Hcyclopenta(a)phenanthren3(2H6H10H)ylidene)amino)oxy)acetamide
O=C(CON=C1CC(C@)2(C(=C1)CC(C@@H)1(C@@H)2CC(C@)2((C@H)1CC(C@)2(O)C(=O)C)C)C)NCCc1c(nH)c2c1cccc2
ZINC001772492224
ZINC001772492227
Check stock
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