Vitas-M small molecule compound
N-[({[(3Z,8xi,9xi,14xi,17xi)-20-oxopregn-4-en-3-ylidene]amino}oxy)acetyl]glycyltryptophan
Catalog ID
STL526003
SMILES O=C(NCC(=O)NC(C(=O)O)Cc1c[nH]c2c1cccc2)CO/N=C\1/CC[C@]2(C(=C1)CCC1C2CC[C@]2(C1CCC2C(=O)C)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 C36H46N4O6 MW 630.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H46N4O6/c1-21(41)27-10-11-28-26-9-8-23-17-24(12-14-35(23,2)29(26)13-15-36(27,28)3)40-46-20-33(43)38-19-32(42)39-31(34(44)45)16-22-18-37-30-7-5-4-6-25(22)30/h4-7,17-18,26-29,31,37H,8-16,19-20H2,1-3H3,(H,38,43)(H,39,42)(H,44,45)/b40-24-/t26?,27?InChIKey
KGCTXKCLVFUXGT-JOGZQOBHSA-NSynonyms
16396945
2((2((2((~(Z))((10~(R)13~(S))17acetyl1013dimethyl126789111214151617dodecahydrocyclopenta(a)phenanthren3ylidene)amino)oxyacetyl)amino)acetyl)amino)3(1~(H)indol3yl)propanoicacid
2(2(2((((10R13S)17acetyl1013dimethyl78911121314151617decahydro1Hcyclopenta(a)phenanthren3(2H6H10H)ylidene)amino)oxy)acetamido)acetamido)3(1Hindol3yl)propanoicacid
InChI=1SC36H46N4O6c121(41)271011282698231724(121435(232)29(26)131536(2728)3)40462033(43)381932(42)3931(34(44)45)1622183730754625(22)30h47171826293137H8161920H213H3(H3843)(H3942)(H4445)b4024t26?27?28?29?31?3536+m0s1
MFCD02184570
N(((((3Z8xi9xi14xi17xi)20oxopregn4en3ylidene)amino)oxy)acetyl)glycyltryptophan
O=C(NCC(=O)NC(C(=O)O)Cc1c(nH)c2c1cccc2)CON=C1CC(C@)2(C(=C1)CCC1C2CC(C@)2(C1CCC2C(=O)C)C)C
ZINC000253503222
ZINC000253503230
Check stock
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