Chemical Compound

2-[2-[[2-[2-[[(4S)-4-[[4-[(2-amino-4-oxo-1H-pteridin-6-yl)methylamino]benzoyl]amino]-5-hydroxy-5-oxopentanoyl]amino]ethylamino]-2-oxoethyl]-(2-oxido-2-oxoethyl)amino]ethyl-[2-[bis(2-oxido-2-oxoethyl)amino]ethyl]amino]acetate; indium-111

2-[2-[[2-[2-[[(4S)-4-[[4-[(2-amino-4-oxo-1H-pteridin-6-yl)methylamino]benzoyl]amino]-5-hydroxy-5-oxopentanoyl]amino]ethylamino]-2-oxoethyl]-(2-oxido-2-oxoethyl)amino]ethyl-[2-[bis(2-oxido-2-oxoethyl)amino]ethyl]amino]acetate; indium-111 结构式
Primary record

2-[2-[[2-[2-[[(4S)-4-[[4-[(2-amino-4-oxo-1H-pteridin-6-yl)methylamino]benzoyl]amino]-5-hydroxy-5-oxopentanoyl]amino]ethylamino]-2-oxoethyl]-(2-oxido-2-oxoethyl)amino]ethyl-[2-[bis(2-oxido-2-oxoethyl)amino]ethyl]amino]acetate; indium-111

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
135465061
SMILES
C1=CC(=CC=C1C(=O)N[C@@H](CCC(=O)NCCNC(=O)CN(CCN(CCN(CC(=O)[O-])CC(=O)[O-])CC(=O)[O-])CC(=O)[O-])C(=O)O)NCC2=CN=C3C(=N2)C(=O)NC(=N3)N.[111In]
Canonical SMILES
Nc1nc2ncc(CNc3ccc(C(=O)N[C@@H](CCC(=O)NCCNC(=O)CN(CCN(CCN(CC(=O)[O-])CC(=O)[O-])CC(=O)[O-])CC(=O)[O-])C(=O)O)cc3)nc2c(=O)[nH]1.[111In]

名称与同义词

  • 111In-DTPA-folate
  • AC1O4BPW
  • CID6364505
  • 111Indium-diethylenetriaminepentaacetic acid-folate
  • 2-[2-[[2-[2-[[(4S)-4-[[4-[(2-amino-4-oxo-1H-pteridin-6-yl)methylamino]benzoyl]amino]-5-hydroxy-5-oxopentanoyl]amino]ethylamino]-2-oxoethyl]-(2-oxido-2-oxoethyl)amino]ethyl-[2-[bis(2-oxido-2-oxoethyl)amino]ethyl]amino]acetate; indium-111