Vitas-M small molecule compound
(8xi,9xi,14xi,17xi)-20-oxopregn-5-en-3-yl 3-(morpholin-4-yl)propanoate
Catalog ID
STL525583
SMILES O=C(OC1CC[C@]2(C(=CCC3C2CC[C@]2(C3CCC2C(=O)C)C)C1)C)CCN1CCOCC1
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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 C28H43NO4 MW 457.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H43NO4/c1-19(30)23-6-7-24-22-5-4-20-18-21(33-26(31)10-13-29-14-16-32-17-15-29)8-11-27(20,2)25(22)9-12-28(23,24)3/h4,21-25H,5-18H2,1-3H3/t21?,22?,23?,24?,25?,27-,28+/m0/s1InChIKey
HFUAUHBPXIPIFS-ACLPAAORSA-NSynonyms
((10~(R)13~(S))17acetyl1013dimethyl234789111214151617dodecahydro1~(H)cyclopenta(a)phenanthren3yl)3morpholin4ylpropanoate
(10R13S)17acetyl1013dimethyl2347891011121314151617tetradecahydro1Hcyclopenta(a)phenanthren3yl3morpholinopropanoate
(8xi9xi14xi17xi)20oxopregn5en3yl3(morpholin4yl)propanoate
16396575
InChI=1SC28H43NO4c119(30)2367242254201821(3326(31)101329141632171529)81127(202)25(22)91228(2324)3h42125H518H213H3t21?22?23?24?25?2728+m0s1
MFCD01881827
O=C(OC1CC(C@)2(C(=CCC3C2CC(C@)2(C3CCC2C(=O)C)C)C1)C)CCN1CCOCC1
ZINC000020111504
ZINC000253499444
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