Vitas-M small molecule compound
(7alpha)-3,7-dihydroxy-N'-[(3Z)-5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene]cholane-24-hydrazide
Catalog ID
STK381407
SMILES OC1CCC2(C(C1)C[C@H](C1C2CCC2(C1CCC2C(CCC(=O)N/N=C/1\C(=O)Nc2c1cc(cc2)[N+](=O)[O-])C)C)O)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 C32H44N4O6 MW 580.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H44N4O6/c1-17(4-9-27(39)34-35-29-21-16-19(36(41)42)5-8-25(21)33-30(29)40)22-6-7-23-28-24(11-13-32(22,23)3)31(2)12-10-20(37)14-18(31)15-26(28)38/h5,8,16-18,20,22-24,26,28,37-38H,4,6-7,9-15H2,1-3H3,(H,34,39)(H,33,35,40)/t17?,18?,20?,22?,23?,24?,InChIKey
KSWAFYAIOOUUMS-FWRSBWOKSA-NSynonyms
(7alpha)37dihydroxyN((3Z)5nitro2oxo12dihydro3Hindol3ylidene)cholane24hydrazide
4((7R)37dihydroxy1013dimethyl23456789111214151617tetradecahydro1Hcyclopenta(a)phenanthren17yl)N(5nitro2oxoindol3yl)pentanehydrazide
CC(CCC(=O)NNC1=C2C=C(C=CC2=NC1=O)(N+)(=O)(O))C3CCC4C3(CCC5C4C(CC6C5(CCC(C6)O)C)O)C
InChI=1SC32H44N4O6c117(4927(39)343529211619(36(41)42)5825(21)3330(29)40)2267232824(111332(2223)3)31(2)121020(37)1418(31)1526(28)38h58161820222426283738H467915H213H3(H3439)(H333540)t17?18?20?22?23?24?2628?31?32?m1s1
MFCD02760390
OC1CCC2(C(C1)C(C@H)(C1C2CCC2(C1CCC2C(CCC(=O)NN=C1C(=O)Nc2c1cc(cc2)(N+)(=O)(O))C)C)O)C
ZINC000253499173
ZINC000253499193
Check stock
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Check stock on Vitas-MAvailable files
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