Primary Record
SCHEMBL19057209
- In stock
- 550 g
- Purity
- 98.1 %
Compound Identifiers & Properties
- PubChem CID
- 129308308
- SMILES
- CCCC1O[C@@H]2C[C@H]3[C@@H]4CCC5=CC(=O)C=C[C@@]5([C@H]4[C@H](C[C@@]3([C@@]2(O1)C(=O)COP(=O)(O)OCC6=CC=C(C=C6)NC(=O)[C@H](CCCNC(=O)N)NC(=O)[C@H](C(C)C)NC(=O)COC7CCCCCC#C7)C)O)C
- Canonical SMILES
- CCCC1O[C@@H]2C[C@H]3[C@@H]4CCC5=CC(=O)C=C[C@]5(C)[C@H]4[C@@H](O)C[C@]3(C)[C@]2(C(=O)COP(=O)(O)OCc2ccc(NC(=O)[C@H](CCCNC(N)=O)NC(=O)[C@@H](NC(=O)COC3C#CCCCCC3)C(C)C)cc2)O1
Names & Synonyms
- SCHEMBL19057209
- J3.553.259E
- ({4-[(2S)-5-(carbamoylamino)-2-[(2S)-2-[2-(cyclooct-2-yn-1-yloxy)acetamido]-3-methylbutanamido]pentanamido]phenyl}methoxy)({2-[(1S,2S,4R,8S,9S,11S,12S,13R)-11-hydroxy-9,13-dimethyl-16-oxo-6-propyl-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-14,17-dien-8-yl]-2-oxoethoxy})phosphinic acid
- Phosphoric acid [4-[(2S)-2-[(2S)-2-[(1-cyclooctyne-3-yloxy)ethanoyl]amino-3-methylbutanoyl]amino-5-ureidopentanoyl]aminobenzyl][2-[(4aR,4bS,5S,6aS,6bS,9aR,10aS,10bS)-5-hydroxy-4a,6a-dimethyl-2-oxo-8-propyl-2,4a,4b,5,6,6a,6b,9a,10,10a,10b,11-dodecahydro-12H-naphtho[2 ,1 :4,5]indeno[1,2-d][1,3]dioxole-6b-yl]-2-oxoethyl] ester