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Chemical structure of Tomaymycin DM

GC70043

Tomaymycin DM

Also known as (6aS)-3-hydroxy-2-methoxy-8-methylidene-7,9-dihydro-6aH-pyrrolo[2,1-c][1,4]benzodiazepin-11-one

Tomaymycin DM is a DNA alkylating agent and a derivative of Tomaymycin· It is a monomer of PBD and can serve as an effective payload for tumor-targeting antibody-drug conjugates (ADCs)

ChemicalCAS945490-09-5MW258.27FormulaC14H14N2O3
CAS number
945490-09-5
Molecular weight
258.27
Formula
C14H14N2O3
Solubility
DMSO : 100 mg/mL (387·19 mM; Need ultrasonic)
InChIKey
GXKVYHPROGIVCL-VIFPVBQESA-N
Catalogue number
GC70043
Brand
GLPBIO
Computed properties PubChem CID 60062462 · XLogP 0.6 · TPSA 62.1 Ų · H-bond donors 1
XLogP
0.6
TPSA
62.1 Ų
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
19

SMILES COC1=C(C=C2C(=C1)C(=O)N3CC(=C)C[C@H]3C=N2)O

Computed descriptors from PubChem (CID 60062462), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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