Dbu-lys-daunomycin NaCl
Molecular Formula:
C37H49ClN5NaO12
InChI: InChI=1/C37H49N5O12.ClH.Na/c1-16-30(44)22(42-36(50)21(8-4-5-11-38)41-35(49)20(40)10-12-39)13-25(53-16)54-24-15-37(51,17(2)43)14-19-27(24)34(48)29-28(32(19)46)31(45)18-7-6-9-23(52-3)26(18)33(29)47;;/h6-7,9,16,20-22,24-25,30,44,46,48,51H,4-5,8,10-15,38-40H2,1-3H3,(H,41,49)(H,42,50);1H;/q;;+1/p-1/t16u,20?,21u,22?,24-,25?,30?,37-;;/m0../s1/fC37H49N5O12.Cl.Na/h41-42H;1h;/q;-1;m
InChIKey: InChIKey=FJTAOOUVDVQVFN-FCVAFICHDH
SMILES: CC1C(C(CC(O1)OC2CC(CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5OC)O)(C(=O)C)O)NC(=O)C(CCCCN)NC(=O)C(CCN)N)O.[Na+].[Cl-]
Names:
Dbu-lys-daunomycin NaCl
NSC332581
sodium N-[6-[[(1S,3R)-3-acetyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl]oxy]-3-hydroxy-2-methyl-oxan-4-yl]-6-amino-2-(2,4-diaminobutanoylamino)hexanamide chloride
Registries:
PubChem CID 5458740
PubChem ID 8141266
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