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Chemical structure of SJG-136 (NSC-694501)

GC34086

SJG-136 (NSC-694501)

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

SJG-136 (NSC-694501) is a DNA cross-linking agent, with an XL50 of 45 nM for pBR322 DNA· SJG-136 (NSC-694501) has potent antitumor activity

ChemicalCAS232931-57-6MW556.61FormulaC31H32N4O6
CAS number
232931-57-6
Molecular weight
556.61
Formula
C31H32N4O6
Solubility
DMSO： ≥ 100 mg/mL (179·66 mM)
InChIKey
RWZVMMQNDHPRQD-SFTDATJTSA-N
Catalogue number
GC34086
Brand
GLPBIO
Computed properties PubChem CID 393111 · XLogP 1.9 · TPSA 102 Ų · H-bond donors 0
XLogP
1.9
TPSA
102 Ų
H-bond donors
0
H-bond acceptors
8
Rotatable bonds
8
Heavy atoms
41

SMILES COC1=C(C=C2C(=C1)C(=O)N3CC(=C)C[C@H]3C=N2)OCCCOC4=C(C=C5C(=C4)N=C[C@@H]6CC(=C)CN6C5=O)OC

Computed descriptors from PubChem (CID 393111), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

Lead time
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Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
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