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Capreomycin IIA [62639-89-8]

 
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Identification
Copyright
CAS # 62639-89-8, Capreomycin IIA
Name
Capreomycin IIA
Synonyms
[(Z)-[(3S,9S,12S,15S)-15-Amino-9-(Aminomethyl)-3-[(4R)-2-Amino-3,4,5,6-Tetrahydropyrimidin-4-Yl]-2,5,8,11,14-Pentaketo-12-Methylol-1,4,7,10,13-Pentazacyclohexadec-6-Ylidene]Methyl]Urea; Brn 0875651; Capreomycin Ia, 1-De-(L-3,6-Diaminohexanoic Acid)-
Molecular Formula
C19H32N12O7
Molecular Weight 540.54
CAS Registry Number
62639-89-8
SMILES
[C@H]1(NC(=NCC1)N)[C@@H]2NC(=O)\C(NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CNC2=O)CO)CN)=C\NC(=O)N
InChI
1S/C19H32N12O7/c20-3-9-14(34)28-10(5-26-19(23)38)15(35)31-12(8-1-2-24-18(22)30-8)17(37)25-4-7(21)13(33)29-11(6-32)16(36)27-9/h5,7-9,11-12,32H,1-4,6,20-21H2,(H,25,37)(H,27,36)(H,28,34)(H,29,33)(H,31,35)(H3,22,24,30)(H3,23,26,38)/b10-5-/t7-,8+,9-,11-,12-/m0/s1
InChIKey XFGCTBYTRMLWCB-MRSVHRRQSA-N
down Properties
Desity 1.886g/cm3 (Cal.)  ref.
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