MOLI000202
Molecular Formula:
C34H41N2O4S2Tc+
InChI: InChI=1/C34H44N2O3S2.O.Tc/c1-3-13-34(39)14-12-30-28-10-8-25-19-26(37)9-11-27(25)32(28)29(20-33(30,34)2)24-6-4-23(5-7-24)21-36(16-18-41)22-31(38)35-15-17-40;;/h4-7,19,28-30,39H,8-12,14-18,20-22H2,1-2H3,(H3,35,38,40,41);;/q;;+4/p-3/t28u,29-,30+,33+,34+;;/m1../s1/i;;1+1/fC34H41N2O3S2.O.Tc/q-3;;m/rC34H44N2O3S2.OTc/c1-3-13-34(39)14-12-30-28-10-8-25-19-26(37)9-11-27(25)32(28)29(20-33(30,34)2)24-6-4-23(5-7-24)21-36(16-18-41)22-31(38)35-15-17-40;1-2/h4-7,19,28-30,39H,8-12,14-18,20-22H2,1-2H3,(H3,35,38,40,41);/q;+4/p-3/t28u,29-,30+,33+,34+;/m1./s1/i;2+1/fC34H41N2O3S2.OTc/q-3;m
InChIKey: InChIKey=ALDSGGQNCMXRQR-WDTYHNSAHQ
SMILES: CC#CC1(CCC2C1(CC(C3=C4CCC(=O)C=C4CCC23)C5=CC=C(C=C5)CN(CC[S-])CC(=O)[N-]CC[S-])C)O.O=[Tc+4]
Names:
MOLI000202
2-[[4-[(11R,13S,14S,17S)-17-hydroxy-13-methyl-3-oxo-17-prop-1-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-11-yl]phenyl]methyl-(2-sulfidoethylazanidylcarbonylmethyl)amino]ethanethiolate; oxotechnetium
Registries:
PubChem CID 6326812
PubChem ID 192
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|