Actinomycin I from Streptomyces antibioticus

2-amino-1-N-[18-hydroxy-7,11,14-trimethyl-2,5,9,12,15-pentaoxo-3,10-di(propan-2-yl)-8-oxa-1,4,11,14-tetrazabicyclo[14.3.0]nonadecan-6-yl]-4,6-dimethyl-3-oxo-9-N-[7,11,14-trimethyl-2,5,9,12,15-pentaoxo-3,10-di(propan-2-yl)-8-oxa-1,4,11,14-tetrazabicyclo[14.3.0]nonadecan-6-yl]phenoxazine-1,9-dicarboxamide

Also Known As: ACTINOMYCIN XOA|Actinomycin X0(beta)|Actinomycin IV|Actinomycin X0(delta)|Actinomycin XO .beta.|ACTINOMYCIN XOB|Actinomycin XO .delta.|MEGxm0_000457|Actinomycin I from Streptomyces antibioticus|ACon0_000470|3H-Phenoxazine, actinomycin D deriv.|3H-Phenoxazine, actinomycin D deriv|3(sup A)-(4-Hydroxy-L-proline)actinomycin D|3(sup A)-(cis-4-Hydroxy-L-proline)actinomycin D|Actinomycin D, 3(sup A)-(4-hydroxy-L-proline)-|ACTINOMYCIN I FROM STREPTOMYCESANTIBIOTI CUS|Actinomycin D, 3'-(4-hydroxy-L-proline)-|Actinomycin D, 3(sup A)-(cis-4-hydroxy-L-proline)-|3A-[(4S)-4-Hydroxy-L-proline]actinomycin D|Actinomycin D, 3(A)-(cis-4-hydroxy-L-proline)-|2-amino-1-N-[18-hydroxy-7,11,14-trimethyl-2,5,9,12,15-pentaoxo-3,10-di(propan-2-yl)-8-oxa-1,4,11,14-tetrazabicyclo[14.3.0]nonadecan-6-yl]-4,6-dimethyl-3-oxo-9-N-[7,11,14-trimethyl-2,5,9,12,15-pentaoxo-3,10-di(propan-2-yl)-8-oxa-1,4,11,14-tetrazabicyclo[14.3.0]nonadecan-6-yl]phenoxazine-1,9-dicarboxamide|633-768-6

Molecular Formula	C62H86N12O17
Molecular Weight	1270.6234 g/mol
LogP	2.8
Topological Polar Surface Area	376.0 Ų
Hydrogen Bond Donors	6
Hydrogen Bond Acceptors	19
Rotatable Bonds	8
Exact Mass	1270.6234
Monoisotopic Mass	1270.6234
Heavy Atoms	91
Complexity	3070.0

Chemical Identifiers

CAS Number	67541-75-7
SMILES	CC1C(C(=O)NC(C(=O)N2CCCC2C(=O)N(CC(=O)N(C(C(=O)O1)C(C)C)C)C)C(C)C)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)C7CC(CN7C(=O)C(NC6=O)C(C)C)O)C)C)C(C)C)C)N)C
InChIKey	NHBSPDCGDJCFKE-UHFFFAOYSA-N