Vitas-M small molecule compound
(8xi,9xi,14xi,17xi,20xi)-26-(acetylamino)-16,22-dioxocholest-5-en-3-yl acetate
Catalog ID
STL524795
SMILES CC(CCC(=O)C(C1C(=O)CC2[C@]1(C)CCC1C2CC=C2[C@]1(C)CCC(C2)OC(=O)C)C)CNC(=O)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 C31H47NO5 MW 513.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H47NO5/c1-18(17-32-20(3)33)7-10-27(35)19(2)29-28(36)16-26-24-9-8-22-15-23(37-21(4)34)11-13-30(22,5)25(24)12-14-31(26,29)6/h8,18-19,23-26,29H,7,9-17H2,1-6H3,(H,32,33)/t18?,19?,23?,24?,25?,26?,29?,30-,31-/m0/s1InChIKey
PFKRRQPKHNIBNN-IECCNTKQSA-NSynonyms
((10~(R)13~(S))17(7acetamido6methyl3oxoheptan2yl)1013dimethyl16oxo12347891112141517dodecahydrocyclopenta(a)phenanthren3yl)acetate
(3S8S10R13S17R)17((2S6R)7acetamido6methyl3oxoheptan2yl)1013dimethyl16oxo2347891011121314151617tetradecahydro1Hcyclopenta(a)phenanthren3ylacetate
(8xi9xi14xi17xi20xi)26(acetylamino)1622dioxocholest5en3ylacetate
45934335
C(C@H)(CCC(=O)(C@H)((C@H)1C(=O)CC2(C@)1(C)CCC1(C@H)2CC=C2(C@)1(C)CC(C@@H)(C2)OC(=O)C)C)CNC(=O)C
InChI=1SC31H47NO5c118(173220(3)33)71027(35)19(2)2928(36)16262498221523(3721(4)34)111330(225)25(24)121431(2629)6h81819232629H7917H216H3(H3233)t18?19?23?24?25?26?29?3031m0s1
MFCD01083716
ZINC000253610181
ZINC000253610185
Check stock
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