Vitas-M small molecule compound
(8xi,9xi,14xi,16alpha,17xi)-16-(dimethylamino)-3-hydroxypregn-5-en-20-one
Catalog ID
STL524549
SMILES OC1CC[C@]2(C(=CCC3C2CC[C@]2(C3C[C@H](C2C(=O)C)N(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 C23H37NO2 MW 359.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H37NO2/c1-14(25)21-20(24(4)5)13-19-17-7-6-15-12-16(26)8-10-22(15,2)18(17)9-11-23(19,21)3/h6,16-21,26H,7-13H2,1-5H3/t16?,17?,18?,19?,20-,21?,22+,23+/m1/s1InChIKey
KIIFJDKQTHOFGN-VNSAABAKSA-NSynonyms
(8xi9xi14xi16alpha17xi)16(dimethylamino)3hydroxypregn5en20one
1((10~(R)13~(S)16~(R))16(dimethylamino)3hydroxy1013dimethyl234789111214151617dodecahydro1~(H)cyclopenta(a)phenanthren17yl)ethanone
1((10R13S16R)16(dimethylamino)3hydroxy1013dimethyl2347891011121314151617tetradecahydro1Hcyclopenta(a)phenanthren17yl)ethanone
16396044
InChI=1SC23H37NO2c114(25)2120(24(4)5)13191776151216(26)81022(152)18(17)91123(1921)3h6162126H713H215H3t16?17?18?19?2021?22+23+m1s1
MFCD01547434
OC1CC(C@)2(C(=CCC3C2CC(C@)2(C3C(C@H)(C2C(=O)C)N(C)C)C)C1)C
ZINC000012657114
ZINC000253499588
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