Vitas-M small molecule compound
(8xi,9xi,14xi)-17-hydroxy-3,20-dioxopregn-4-en-21-yl 4-[(2,5-dioxopyrrolidin-1-yl)oxy]-4-oxobutanoate
Catalog ID
STL526810
SMILES O=C(OCC(=O)[C@@]1(O)CCC2[C@]1(C)CCC1C2CCC2=CC(=O)CC[C@]12C)CCC(=O)ON1C(=O)CCC1=O
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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 C29H37NO9 MW 543.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H37NO9/c1-27-12-9-18(31)15-17(27)3-4-19-20(27)10-13-28(2)21(19)11-14-29(28,37)22(32)16-38-25(35)7-8-26(36)39-30-23(33)5-6-24(30)34/h15,19-21,37H,3-14,16H2,1-2H3/t19?,20?,21?,27-,28-,29-/m0/s1InChIKey
CBFHDXFEGKQLNJ-RNARDQSHSA-NSynonyms
(8xi9xi14xi)17hydroxy320dioxopregn4en21yl4((25dioxopyrrolidin1yl)oxy)4oxobutanoate
135639200
25dioxopyrrolidin1yl(2((8R9S10R13S14S17R)17hydroxy1013dimethyl3oxo2367891011121314151617tetradecahydro1Hcyclopenta(a)phenanthren17yl)2oxoethyl)succinate
4~(O)(25dioxopyrrolidin1yl)1~(O)(2((10~(R)13~(S)17~(R))17hydroxy1013dimethyl3oxo267891112141516decahydro1~(H)cyclopenta(a)phenanthren17yl)2oxoethyl)butanedioate
InChI=1SC29H37NO9c12712918(31)1517(27)341920(27)101328(2)21(19)111429(2837)22(32)163825(35)7826(36)393023(33)5624(30)34h15192137H31416H212H3t19?20?21?272829m0s1
MFCD03006064
O=C(OCC(=O)(C@@)1(O)CC(C@@H)2(C@)1(C)CC(C@H)1(C@H)2CCC2=CC(=O)CC(C@)12C)CCC(=O)ON1C(=O)CCC1=O
ZINC001772492385
ZINC001772492388
Check stock
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