479-91-4 Purity
98%
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Specification
The molecular formula of Anthramycin is C16H17N3O4.
The molecular weight of Anthramycin is 315.32 g/mol.
The IUPAC name of Anthramycin is (E)-3-[(6R,6aS)-4,6-dihydroxy-3-methyl-11-oxo-5,6,6a,7-tetrahydropyrrolo[2,1-c][1,4]benzodiazepin-8-yl]prop-2-enamide.
Anthramycin binds covalently to guanine in the minor groove of DNA, thereby inhibiting DNA replication and RNA and protein synthesis.
The InChIKey of Anthramycin is VGQOVCHZGQWAOI-YQRHFANHSA-N.
The canonical SMILES representation of Anthramycin is CC1=C(C2=C(C=C1)C(=O)N3C=C(CC3C(N2)O)C=CC(=O)N)O.
The CAS number of Anthramycin is 4803-27-4.
Anthramycin is a natural product isolated from Streptomyces refuineus subsp. thermotolerans.
Some computed properties of Anthramycin include a hydrogen bond donor count of 4, a hydrogen bond acceptor count of 5, and a rotatable bond count of 2.
Anthramycin has roles as a bacterial metabolite, an alkylating agent, a toxin, an antineoplastic agent, and an antibacterial agent.