Oxi-4503
[3-methoxy-2-phosphonooxy-6-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl] dihydrogen phosphate
Molecular Identity
Oxi-4503
[3-methoxy-2-phosphonooxy-6-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl] dihydrogen phosphate
PubChem CID: 6918546
2D Structure
Properties
C18H22O12P2
Molecular Formula
492.30
Molecular Weight
g/mol
492.0587
Exact Mass
Da
0.8
XLogP
Drug-like (Lipinski: < 5)
170
TPSA
May have limited oral absorption
4
H-Bond Donors
12
H-Bond Acceptors
692
Complexity
SMILES
Canonical SMILES
SMILES: COC1=C(C(=C(C=C1)C=CC2=CC(=C(C(=C2)OC)OC)OC)OP(=O)(O)O)OP(=O)(O)OIsomeric SMILES
SMILES: COC1=C(C(=C(C=C1)/C=C\C2=CC(=C(C(=C2)OC)OC)OC)OP(=O)(O)O)OP(=O)(O)OSynonyms(20)
288847-35-8Combretastatin A-1 bis(phosphate)OXI-4503OXi4503OXI 4503CA1PJH6Z94GLUDCombretastatin A-1 phosphateCombretastatin A1 Diphosphate1,2-Benzenediol, 3-methoxy-6-((1Z)-2-(3,4,5-trimethoxyphenyl)ethenyl)-, 1,2-bis(dihydrogen phosphate)1,2-Benzenediol, 3-methoxy-6-[(1Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]-, 1,2-bis(dihydrogen phosphate)RefChem:168909(3-methoxy-2-(phosphonooxy)-6-((Z)-2-(3,4,5-trimethoxyphenyl)ethenyl)phenoxy)phosphonic acidNSC600032UNII-JH6Z94GLUD
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Oxi-4503
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