Molecular Weight: 725.79
Molecular Formula: C42H39N5O7
Canonical SMILES: O=C1C=2C=C(OC)C(OCCCOC3=CC=4N=CC5N(C=C(C=6C=CC(N)=CC6)C5)C(=O)C4C=C3OC)=CC2N=CC7N1C=C(C=8C=CC(OC)=CC8)C7
InChI: InChI=1S/C42H39N5O7/c1-50-32-11-7-26(8-12-32)28-16-31-22-45-36-20-40(38(52-3)18-34(36)42(49)47(31)24-28)54-14-4-13-53-39-19-35-33(17-37(39)51-2)41(48)46-23-27(15-30(46)21-44-35)25-5-9-29(43)10-6-25/h5-12,17-24,30-31H,4,13-16,43H2,1-3H3/t30-,31-/m0/s1
InChIKey: OMRPLUKQNWNZAV-CONSDPRKSA-N
Boiling Point: 977.7±65.0 °C at 760 mmHg
Purity: ≥95%
Solubility: Soluble in DMSO
Storage: 2 - 8 °C
Synonyms: 5H-Pyrrolo[2,1-c][1,4]benzodiazepin-5-one, 2-(4-aminophenyl)-8-[3-[[(11aS)-5,11a-dihydro-7-methoxy-2-(4-methoxyphenyl)-5-oxo-1H-pyrrolo[2,1-c][1,4]benzodiazepin-8-yl]oxy]propoxy]-1,11a-dihydro-7-methoxy-, (11aS)-; (11aS)-2-(4-Aminophenyl)-8-[3-[[(11aS)-5,11a-dihydro-7-methoxy-2-(4-methoxyphenyl)-5-oxo-1H-pyrrolo[2,1-c][1,4]benzodiazepin-8-yl]oxy]propoxy]-1,11a-dihydro-7-methoxy-5H-pyrrolo[2,1-c][1,4]benzodiazepin-5-one; PBD; SGD 1882; SGD1882; SGD-1882; 8-(3-((2-(4-Aminophenyl)-7-methoxy-5-oxo-1,11abeta-dihydro-5H-pyrrolo(2,1-c)(1,4)benzodiazepine-8-yl)oxy)propoxy)-7-methoxy-2-(4-methoxyphenyl)-1,11abeta-dihydro-5H-pyrrolo(2,1-c)(1,4)benzodiazepine-5-one; Pyrrolobenzodiazepine Dimer (PBD Dimer)
DescriptionPBD dimer is a cytotoxic agent, used as the cytotoxic component in antibody-drug conjugates.
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