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Distamycin A

CAT: 0931-T73730-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-T73730-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
636-47-5
Target
Apoptosis, Others, Antibiotic
Related Pathways
Apoptosis, Microbiology/Virology, Others
Bioactivity
Distamycin A (NSC-82150), an oligopeptide antibiotic, functions as a minor groove binder targeting B-form DNA, primarily at A/T-rich locations. It modifies enediyne-induced DNA cleavage sites and promotes apoptosis, as evidenced by sources [1] [2] [3].
Smiles
Cn1cc(NC=O)cc1C(=O)Nc1cc(C(=O)Nc2cc(C(=O)NCCC(N)=N)n(C)c2)n(C)c1
Molecular Formula
C22H27N9O4
Molecular Weight
481.51
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Distamycin A

Stallimycin is a small molecule drug. The usage of the INN stem '-mycin' in the name indicates that Stallimycin is a antibiotic, produced by Streptomyces strain. Stallimycin has a monoisotopic molecular weight of 481.22 Da.

CAS Number636-47-5
PubChem CID3115
IUPAC NameN-[5-[[5-[(3-amino-3-iminopropyl)carbamoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]-4-formamido-1-methylpyrrole-2-carboxamide
Molecular FormulaC22H27N9O4
Molecular Weight481.5
XLogP-1.8
Topological Polar Surface Area181
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count5
Rotatable Bond Count9
Heavy Atom Count35
Formal Charge0
Complexity825
SMILES
CN1C=C(C=C1C(=O)NC2=CN(C(=C2)C(=O)NC3=CN(C(=C3)C(=O)NCCC(=N)N)C)C)NC=O
InChI
InChI=1S/C22H27N9O4/c1-29-9-13(26-12-32)6-17(29)21(34)28-15-8-18(31(3)11-15)22(35)27-14-7-16(30(2)10-14)20(33)25-5-4-19(23)24/h6-12H,4-5H2,1-3H3,(H3,23,24)(H,25,33)(H,26,32)(H,27,35)(H,28,34)
InChIKey
UPBAOYRENQEPJO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Distamycin A
CAS: 636-47-5
CID: 3115
Formula: C22H27N9O4
MW: 481.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight481.5
XLogP3-1.8
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count5
Rotatable Bond Count9
Exact Mass481.21860038
Monoisotopic Mass481.21860038
Topological Polar Surface Area181 Ų
Heavy Atom Count35
Formal Charge0
Complexity825
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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