DAUNOMYCIN, PRO-LYS-
Molecular Formula:
C38H48ClN4NaO12
InChI: InChI=1/C38H48N4O12.ClH.Na/c1-17-31(44)23(42-37(50)22(9-4-5-12-39)41-36(49)21-10-7-13-40-21)14-26(53-17)54-25-16-38(51,18(2)43)15-20-28(25)35(48)30-29(33(20)46)32(45)19-8-6-11-24(52-3)27(19)34(30)47;;/h6,8,11,17,21-23,25-26,31,40,44,46,48,51H,4-5,7,9-10,12-16,39H2,1-3H3,(H,41,49)(H,42,50);1H;/q;;+1/p-1/t17u,21u,22u,23?,25-,26?,31?,38-;;/m0../s1/fC38H48N4O12.Cl.Na/h41-42H;1h;/q;-1;m
InChIKey: InChIKey=GCWVTFQJIQJHLZ-KGMIXNRDDU
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)C6CCCN6)O.[Na+].[Cl-]
Names:
DAUNOMYCIN, PRO-LYS-
NSC332582
sodium N-[1-[[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]carbamoyl]-5-amino-pentyl]pyrrolidine-2-carboxamide chloride
Registries:
PubChem CID 5458742
PubChem ID 8141267
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