Drug Information

Drug General Information
Drug ID
D05ITH
Former ID
DNC000579
Drug Name
Duocarmycin
Drug Type
Small molecular drug
Indication Discovery agent Investigative [534930]
Structure
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2D MOL

3D MOL
Formula
C26H27N3O8
Canonical SMILES
CC1CN(C2=CC(=C3C(=C12)C(=O)C(N3)(C)C(=O)OC)O)C(=O)C4=CC<br />5=CC(=C(C(=C5N4)OC)OC)OC
InChI
1S/C26H27N3O8/c1-11-10-29(14-9-15(30)20-18(17(11)14)23(31)26(2,28-20)25(33)37-6)24(32)13-7-12-8-16(34-3)21(35-4)22(36-5)19(12)27-13/h7-9,11,27-28,30H,10H2,1-6H3
InChIKey
WQAYQZWERWNDPV-UHFFFAOYSA-N
PubChem Compound ID
3175
PubChem Substance ID
7726233, 29222317, 74896666, 104302744, 126407546, 162974980, 221672813
Target and Pathway
Target(s) DNA Target Info Breaker [534930]
References
Ref 534930Structural studies of atom-specific anticancer drugs acting on DNA. Pharmacol Ther. 1999 Sep;83(3):181-215.
Ref 534930Structural studies of atom-specific anticancer drugs acting on DNA. Pharmacol Ther. 1999 Sep;83(3):181-215.

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