Vitas-M small molecule compound
({[(3Z,8xi,9xi,14xi)-17-(propanoyloxy)androst-4-en-3-ylidene]amino}oxy)acetic acid
Catalog ID
STL525798
SMILES CCC(=O)OC1CCC2[C@]1(C)CCC1C2CCC2=C/C(=N\OCC(=O)O)/CC[C@]12C
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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 C24H35NO5 MW 417.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H35NO5/c1-4-22(28)30-20-8-7-18-17-6-5-15-13-16(25-29-14-21(26)27)9-11-23(15,2)19(17)10-12-24(18,20)3/h13,17-20H,4-12,14H2,1-3H3,(H,26,27)/b25-16-/t17?,18?,19?,20?,23-,24-/m0/s1InChIKey
ZXQPFGVRKHFTFV-FRYZWKNDSA-NSynonyms
((((3Z8xi9xi14xi)17(propanoyloxy)androst4en3ylidene)amino)oxy)aceticacid
16396553
2(((Z)((10R13S)1013dimethyl17(propionyloxy)78911121314151617decahydro1Hcyclopenta(a)phenanthren3(2H6H10H)ylidene)amino)oxy)aceticacid
2((~(Z))((10~(R)13~(S))1013dimethyl17propanoyloxy126789111214151617dodecahydrocyclopenta(a)phenanthren3ylidene)amino)oxyaceticacid
CCC(=O)OC1CCC2(C@)1(C)CCC1C2CCC2=CC(=NOCC(=O)O)CC(C@)12C
InChI=1SC24H35NO5c1422(28)302087181765151316(25291421(26)27)91123(152)19(17)101224(1820)3h131720H41214H213H3(H2627)b2516t17?18?19?20?2324m0s1
MFCD01881647
ZINC000005710993
ZINC000253500235
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