Vitas-M small molecule compound
(8xi,9xi,10xi,13xi,14xi)-17-hydroxy-20-oxopregn-5-en-3-yl acetate
Catalog ID
STK366326
SMILES CC(=O)OC1CCC2(C(=CCC3C2CCC2(C3CC[C@]2(O)C(=O)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 C23H34O4 MW 374.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H34O4/c1-14(24)23(26)12-9-20-18-6-5-16-13-17(27-15(2)25)7-10-21(16,3)19(18)8-11-22(20,23)4/h5,17-20,26H,6-13H2,1-4H3/t17?,18?,19?,20?,21?,22?,23-/m0/s1InChIKey
IQCNQJXIOWBNAT-FCXZXHHASA-NSynonyms
((17R)17acetyl17hydroxy1013dimethyl12347891112141516dodecahydrocyclopenta(a)phenanthren3yl)acetate
(3S8R10R13S17R)17acetyl17hydroxy1013dimethyl2347891011121314151617tetradecahydro1Hcyclopenta(a)phenanthren3ylacetate
(8xi9xi10xi13xi14xi)17hydroxy20oxopregn5en3ylacetate
CC(=O)C1(CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)C)C)C)O
CC(=O)O(C@H)1CC(C@)2(C(=CC(C@@H)3C2CC(C@)2(C3CC(C@)2(O)C(=O)C)C)C1)C
CC(=O)OC1CCC2(C(=CCC3C2CCC2(C3CC(C@)2(O)C(=O)C)C)C1)C
InChI=1SC23H34O4c114(24)23(26)129201865161317(2715(2)25)71021(163)19(18)81122(2023)4h5172026H613H214H3t17?18?19?20?21?22?23m0s1
MFCD00367372
ZINC000253498097
ZINC000253498100
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