Actinomycin vii

2-amino-1-N,9-N-bis(3-butan-2-yl-7,11,14-trimethyl-2,5,9,12,15-pentaoxo-10-propan-2-yl-8-oxa-1,4,11,14-tetrazabicyclo[14.3.0]nonadecan-6-yl)-4,6-dimethyl-3-oxophenoxazine-1,9-dicarboxamide

Also Known As: Actinomycin vii|Actinomycin C3|Actinomycin I3|Actinomycin AY1|Aurathin-A3|AY 3|2104-L-I|2A-D-Alloisoleucine-2B-D-alloisoleucine actinomycino-D|2-amino-1-N,9-N-bis(3-butan-2-yl-7,11,14-trimethyl-2,5,9,12,15-pentaoxo-10-propan-2-yl-8-oxa-1,4,11,14-tetrazabicyclo[14.3.0]nonadecan-6-yl)-4,6-dimethyl-3-oxophenoxazine-1,9-dicarboxamide|Actinomycin D, 2(sup A)-D-alloisoleucine-2(sup B)-D-alloisoleucine-|2-Amino-4,6-dimethyl-3-oxo-3H-phenoxazine-1,9-dicarboxylic acid bis-[(5-sec-butyl-12-isopropyl-9,13,16-trimethyl-4,7,11,14,17-pentaoxo-hexadecahydro-10-oxa-3a,6,13,16-tetraaza-cyclopentacyclohexadecen-8-yl)-amide]|2-amino-N1,N9-bis(10-isopropyl-7,11,14-trimethyl-2,5,9,12,15-pentaoxo-3-sec-butyl-8-oxa-1,4,11,14-tetrazabicyclo[14.3.0]nonadecan-6-yl)-4,6-dimethyl-3-oxo-phenoxazine-1,9-dicarboxamide|3H-Phenoxazine-1,9-dicarboxamide, 2-amino-N,N'-bis[hexadecahydro-2,5,9-trimethyl-6-(1-methylethyl)-13-(1-methylpropyl)-1,4,7,11,14-pentaoxo-1H-pyrrolo[2,1-i][1,4,7,10,13]oxatetraazacyclohexadecin-10-yl]-4,6-dimethyl-3-oxo-

Molecular Formula	C64H90N12O16
Molecular Weight	1282.6598 g/mol
LogP	1.51
Topological Polar Surface Area	359.98 Ų
Hydrogen Bond Donors	5
Hydrogen Bond Acceptors	18
Rotatable Bonds	10
Exact Mass	1282.6598
Heavy Atoms	92
Complexity	3459.0

Chemical Identifiers

CAS Number	6156-47-4
SMILES	CCC(C)C1C(=O)N2CCCC2C(=O)N(CC(=O)N(C(C(=O)OC(C(C(=O)N1)NC(=O)C3=C4C(=C(C=C3)C)OC5=C(C(=O)C(=C(C5=N4)C(=O)NC6C(OC(=O)C(N(C(=O)CN(C(=O)C7CCCN7C(=O)C(NC6=O)C(C)CC)C)C)C(C)C)C)N)C)C)C(C)C)C)C