DMEA-PNU-159682 (molecule D12) is a ADC cytotoxin molecule including metabolites of nemorubicin (MMDX) from liver microsomes and a potent ADCs cytotoxin PNU-159682.

Product information

CAS Number: 1799421-48-9

Molecular Weight: 755.76

Formula: C37H45N3O14

Chemical Name: 2-oxo-2-((2S, 4S)-2, 5, 12-trihydroxy-7-methoxy-4-(((1S, 3R, 4aS, 9S, 9aR, 10aS)-9-methoxy-1-methyloctahydro-1H-pyrano[4', 3':4, 5]oxazolo[2, 3-c][1, 4]oxazin-3-yl)oxy)-6, 11-dioxo-1, 2, 3, 4, 6, 11-hexahydrotetracen-2-yl)ethyl methyl(2-(methylamino)ethyl)carbamate

Smiles: CN(CCNC)C(=O)OCC(=O)[C@@]1(O)C[C@H](O[C@H]2C[C@H]3[C@H](O[C@@H]4[C@H](OCCN34)OC)[C@H](C)O2)C2=C(C1)C(O)=C1C(C(=O)C3C(=CC=CC=3C1=O)OC)=C2O

InChiKey: XGQVZTMSFDNDRX-KCNAVCIPSA-N

InChi: InChI=1S/C37H45N3O14/c1-17-33-20(40-11-12-50-35(49-5)34(40)54-33)13-24(52-17)53-22-15-37(47,23(41)16-51-36(46)39(3)10-9-38-2)14-19-26(22)32(45)28-27(30(19)43)29(42)18-7-6-8-21(48-4)25(18)31(28)44/h6-8,17,20,22,24,33-35,38,43,45,47H,9-16H2,1-5H3/t17-,20-,22-,24-,33+,34+,35-,37-/m0/s1

Technical Data

Appearance: Solid Power

Purity: ≥98% (or refer to the Certificate of Analysis)

Shipping Condition: Shipped under ambient temperature as non-hazardous chemical or refer to Certificate of Analysis

Storage Condition: Dry, dark and -20 ^oC for 1 year or refer to the Certificate of Analysis.

Shelf Life: ≥12 months if stored properly.

Stock Solution Storage: 0 - 4 ^oC for 1 month or refer to the Certificate of Analysis.

Drug Formulation: To be determined

HS Tariff Code: 382200

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