Vitas-M small molecule compound
6-methyl-20-oxopregna-4,6-diene-3,17-diyl diacetate
Catalog ID
STL146308
SMILES CC(=O)OC1CCC2(C(=C1)C(=CC1C2CCC2(C1CCC2(OC(=O)C)C(=O)C)C)C)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 C26H36O5 MW 428.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H36O5/c1-15-13-20-21(24(5)10-7-19(14-23(15)24)30-17(3)28)8-11-25(6)22(20)9-12-26(25,16(2)27)31-18(4)29/h13-14,19-22H,7-12H2,1-6H3InChIKey
SDHHPVPFUVQWKY-UHFFFAOYSA-NSynonyms
(17acetyl17acetyloxy61013trimethyl123891112141516decahydrocyclopenta(a)phenanthren3yl)acetate
(3BETA9BETA17ALPHA)6METHYL20OXOPREGNA46DIENE317DIYLDIACETATE
(3R8R9S10R13S14S17R)17acetyl61013trimethyl23891011121314151617dodecahydro1Hcyclopenta(a)phenanthrene317diyldiacetate
6methyl20oxopregna46diene317diyldiacetate
CC(=O)O(C@@H)1CC(C@)2(C(=C1)C(=C(C@@H)1(C@@H)2CC(C@)2((C@H)1CC(C@)2(OC(=O)C)C(=O)C)C)C)C
CC1=CC2C(CCC3(C2CCC3(C(=O)C)OC(=O)C)C)C4(C1=CC(CC4)OC(=O)C)C
InChI=1SC26H36O5c115132021(24(5)10719(1423(15)24)3017(3)28)81125(6)22(20)91226(2516(2)27)3118(4)29h13141922H712H216H3
MFCD20734733
ZINC000245247221
ZINC000253527923
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