MOLI000933
Molecular Formula:
C28H41NO11STc
InChI: InChI=1/C28H41NO11S.Tc/c1-25-9-19(31)23-17(28(25,38)5-3-16(25)14-6-21(33)39-10-14)2-4-26(37)8-15(7-20(32)27(23,26)13-30)40-22(34)12-41-11-18(29)24(35)36;/h6,15-20,23,30-32,37-38H,2-5,7-13,29H2,1H3,(H,35,36);/t15-,16+,17u,18?,19+,20+,23u,25+,26-,27+,28-;/m0./s1/i;1+1/f/h35H;
InChIKey: InChIKey=USZNIFUQJUTKPT-LOBBCKBAHT
SMILES: CC12CC(C3C(C1(CCC2C4=CC(=O)OC4)O)CCC5(C3(C(CC(C5)OC(=O)CSCC(C(=O)O)N)O)CO)O)O.[Tc]
Names:
MOLI000933
2-amino-3-[[(1R,3S,5S,10S,11R,13R,14S,17S)-1,5,11,14-tetrahydroxy-10-(hydroxymethyl)-13-methyl-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxycarbonylmethylsulfanyl]propanoic acid; technetium
Registries:
PubChem CID 450479
PubChem ID 911
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