Catalog Number:
AG00BXZ1
Chemical Name:
BLASTICIDIN S HYDROCHLORIDE
CAS Number:
3513-03-9
Molecular Formula:
C17H27ClN8O5
Molecular Weight:
458.8999
MDL Number:
MFCD02091640
IUPAC Name:
(2S,3S,6R)-3-[[(3S)-3-amino-5-[carbamimidoyl(methyl)amino]pentanoyl]amino]-6-(4-amino-2-oxopyrimidin-1-yl)-3,6-dihydro-2H-pyran-2-carboxylic acid;hydrochloride
InChI:
InChI=1S/C17H26N8O5.ClH/c1-24(16(20)21)6-4-9(18)8-12(26)22-10-2-3-13(30-14(10)15(27)28)25-7-5-11(19)23-17(25)29;/h2-3,5,7,9-10,13-14H,4,6,8,18H2,1H3,(H3,20,21)(H,22,26)(H,27,28)(H2,19,23,29);1H/t9-,10-,13+,14-;/m0./s1
InChI Key:
YQXYQOXRCNEATG-NMQKUDMSSA-N
SMILES:
N[C@@H](CC(=O)N[C@H]1C=C[C@@H](O[C@@H]1C(=O)O)n1ccc(nc1=O)N)CCN(C(=N)N)C.Cl
EC Number:
609-067-6
