Vitas-M small molecule compound
(10R,13S,17S)-3'-(iodoacetyl)-2',2',10,13-tetramethyl-1,6,7,8,9,10,11,12,13,14,15,16-dodecahydrospiro[cyclopenta[a]phenanthrene-17,5'-[1,3]oxazolidin]-3(2H)-one
Catalog ID
STL524682
SMILES ICC(=O)N1C[C@]2(OC1(C)C)CCC1[C@]2(C)CCC2C1CCC1=CC(=O)CC[C@]21C
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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 C25H36INO3 MW 525.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H36INO3/c1-22(2)27(21(29)14-26)15-25(30-22)12-9-20-18-6-5-16-13-17(28)7-10-23(16,3)19(18)8-11-24(20,25)4/h13,18-20H,5-12,14-15H2,1-4H3/t18?,19?,20?,23-,24-,25+/m0/s1InChIKey
AHMCITDLGPUKFA-LDGXGUHCSA-NSynonyms
(10R13S17S)3(iodoacetyl)221013tetramethyl1678910111213141516dodecahydrospiro(cyclopenta(a)phenanthrene175(13)oxazolidin)3(2H)one
(5~(S)10~(R)13~(S))3(2iodoacetyl)221013tetramethylspiro(13oxazolidine517267891112141516decahydro1~(H)cyclopenta(a)phenanthrene)3one
(5S8R9S10R13S14S)3(2iodoacetyl)221013tetramethyl1678910111213141516dodecahydrospiro(cyclopenta(a)phenanthrene175oxazolidin)3(2H)one
126961530
ICC(=O)N1C(C@)2(OC1(C)C)CC(C@@H)1(C@)2(C)CC(C@H)2(C@H)1CCC1=CC(=O)CC(C@)21C
InChI=1SC25H36INO3c122(2)27(21(29)1426)1525(3022)129201865161317(28)71023(163)19(18)81124(2025)4h131820H5121415H214H3t18?19?20?232425+m0s1
MFCD01082101
ZINC000504340209
ZINC001772491725
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