MITOMYCIN ANALOG structure

MITOMYCIN ANALOG

[(4R,6R,7S,8R)-7-methoxy-5,12-dimethyl-10,13-dioxo-11-(prop-2-ynylamino)-2,5-diazatetracyclo[7.4.0.02,7.04,6]trideca-1(9),11-dien-8-yl]methyl carbamate

Also Known As: MITOMYCIN ANALOG|[(4R,6R,7S,8R)-7-methoxy-5,12-dimethyl-10,13-dioxo-11-(prop-2-ynylamino)-2,5-diazatetracyclo[7.4.0.02,7.04,6]trideca-1(9),11-dien-8-yl]methyl carbamate|{(1aR,8R,8aS,8bR)-8a-Methoxy-1,5-dimethyl-4,7-dioxo-6-[(prop-2-yn-1-yl)amino]-1,1a,2,4,7,8,8a,8b-octahydroazirino[2',3':3,4]pyrrolo[1,2-a]indol-8-yl}methyl carbamate

CAS: 78142-80-0
Molecular Formula C19H22N4O5
Molecular Weight 386.15903 g/mol
LogP 0.4
Topological Polar Surface Area 114.0 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 8
Rotatable Bonds 6
Exact Mass 386.15903
Monoisotopic Mass 386.15903
Heavy Atoms 28
Complexity 913.0

Chemical Identifiers

CAS Number 78142-80-0
SMILES CC1=C(C(=O)C2=C(C1=O)N3C[C@@H]4[C@H]([C@]3([C@H]2COC(=O)N)OC)N4C)NCC#C
InChIKey XKGGUIJGEOKAPP-MHBRSWMOSA-N

Product Overview

MITOMYCIN ANALOG (CAS 78142-80-0), with molecular formula C19H22N4O5 and molecular weight 386.15903 g/mol. IUPAC: [(4R,6R,7S,8R)-7-methoxy-5,12-dimethyl-10,13-dioxo-11-(prop-2-ynylamino)-2,5-diazatetracyclo[7.4.0.02,7.04,6]trideca-1(9),11-dien-8-yl]methyl carbamate.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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