Vitas-M small molecule compound
methyl N-(4-oxo-4-{[(8xi,9xi,14xi)-3-oxoandrost-4-en-17-yl]oxy}butanoyl)tryptophanate
Catalog ID
STL525071
SMILES COC(=O)C(Cc1c[nH]c2c1cccc2)NC(=O)CCC(=O)OC1CCC2[C@]1(C)CCC1C2CCC2=CC(=O)CC[C@]12C
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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 C35H44N2O6 MW 588.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H44N2O6/c1-34-16-14-23(38)19-22(34)8-9-25-26-10-11-30(35(26,2)17-15-27(25)34)43-32(40)13-12-31(39)37-29(33(41)42-3)18-21-20-36-28-7-5-4-6-24(21)28/h4-7,19-20,25-27,29-30,36H,8-18H2,1-3H3,(H,37,39)/t25?,26?,27?,29?,30?,34-,35-/m0/s1InChIKey
KTFDPWUAYAXAMM-IYGMOIEOSA-NSynonyms
((10~(R)13~(S))1013dimethyl3oxo126789111214151617dodecahydrocyclopenta(a)phenanthren17yl)4((3(1~(H)indol3yl)1methoxy1oxopropan2yl)amino)4oxobutanoate
(10R13S)1013dimethyl3oxo2367891011121314151617tetradecahydro1Hcyclopenta(a)phenanthren17yl4((3(1Hindol3yl)1methoxy1oxopropan2yl)amino)4oxobutanoate
16396670
COC(=O)C(Cc1c(nH)c2c1cccc2)NC(=O)CCC(=O)OC1CCC2(C@)1(C)CCC1C2CCC2=CC(=O)CC(C@)12C
InChI=1SC35H44N2O6c134161423(38)1922(34)892526101130(35(262)171527(25)34)4332(40)131231(39)3729(33(41)423)1821203628754624(21)28h4719202527293036H818H213H3(H3739)t25?26?27?29?30?3435m0s1
methylN(4oxo4(((8xi9xi14xi)3oxoandrost4en17yl)oxy)butanoyl)tryptophanate
MFCD02057623
ZINC000254734792
ZINC000254734799
Check stock
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Check stock on Vitas-MAvailable files
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