Vitas-M small molecule compound
N-{(6Z)-6-[(10R,13S)-3-hydroxy-10,13-dimethyl-16-oxo-1,2,3,4,7,8,9,10,11,12,13,14,15,16-tetradecahydro-17H-cyclopenta[a]phenanthren-17-ylidene]-5-oxoheptan-2-yl}acetamide (non-preferred name)
Catalog ID
STL525996
SMILES OC1CC[C@]2(C(=CCC3C2CC[C@]2(C3CC(=O)/C/2=C(\C(=O)CCC(NC(=O)C)C)/C)C)C1)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 C28H41NO4 MW 455.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H41NO4/c1-16(29-18(3)30)6-9-24(32)17(2)26-25(33)15-23-21-8-7-19-14-20(31)10-12-27(19,4)22(21)11-13-28(23,26)5/h7,16,20-23,31H,6,8-15H2,1-5H3,(H,29,30)/b26-17+/t16?,20?,21?,22?,23?,27-,28-/m0/s1InChIKey
VBLIDSOPUZSKNA-SOVFSYTBSA-NSynonyms
~(N)((6~(Z))6((10~(R)13~(S))3hydroxy1013dimethyl16oxo23478911121415decahydro1~(H)cyclopenta(a)phenanthren17ylidene)5oxoheptan2yl)acetamide
16396928
InChI=1SC28H41NO4c116(2918(3)30)6924(32)17(2)2625(33)15232187191420(31)101227(194)22(21)111328(2326)5h716202331H6815H215H3(H2930)b2617+t16?20?21?22?23?2728m0s1
MFCD01545614
N((6Z)6((10R13S)3hydroxy1013dimethyl16oxo123478910111213141516tetradecahydro17Hcyclopenta(a)phenanthren17ylidene)5oxoheptan2yl)acetamide(nonpreferredname)
N((Z)6((10R13S)3hydroxy1013dimethyl16oxo347891112131516decahydro1Hcyclopenta(a)phenanthren17(2H10H14H)ylidene)5oxoheptan2yl)acetamide
OC1CC(C@)2(C(=CCC3C2CC(C@)2(C3CC(=O)C2=C(C(=O)CCC(NC(=O)C)C)C)C)C1)C
ZINC000012659720
ZINC000253500042
Check stock
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Check stock on Vitas-MAvailable files
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