Chemical Compound

(1R,3S,5R,6R,9R,11R,15S,16R,17R,18S,23Z,33R,35S,36R,37S)-33-{[(2R,3S,4S,5S,6R)-3,5-dihydroxy-4-{[(1-hydroxy-1,3-dihydro-2,1-benzoxaborol-6-yl)methyl]amino}-6-methyloxan-2-yl]oxy}-N-[2-(dimethylamino)ethyl]-1,3,5,6,9,11,17,37-octahydroxy-15,16,18-trimethyl-13-oxo-14,39-dioxabicyclo[33.3.1]nonatriaconta-19,21,23,25,27,29,31-heptaene-36-carboxamide

(1R,3S,5R,6R,9R,11R,15S,16R,17R,18S,23Z,33R,35S,36R,37S)-33-{[(2R,3S,4S,5S,6R)-3,5-dihydroxy-4-{[(1-hydroxy-1,3-dihydro-2,1-benzoxaborol-6-yl)methyl]amino}-6-methyloxan-2-yl]oxy}-N-[2-(dimethylamino)ethyl]-1,3,5,6,9,11,17,37-octahydroxy-15,16,18-trimethyl-13-oxo-14,39-dioxabicyclo[33.3.1]nonatriaconta-19,21,23,25,27,29,31-heptaene-36-carboxamide 结构式
Primary record

(1R,3S,5R,6R,9R,11R,15S,16R,17R,18S,23Z,33R,35S,36R,37S)-33-{[(2R,3S,4S,5S,6R)-3,5-dihydroxy-4-{[(1-hydroxy-1,3-dihydro-2,1-benzoxaborol-6-yl)methyl]amino}-6-methyloxan-2-yl]oxy}-N-[2-(dimethylamino)ethyl]-1,3,5,6,9,11,17,37-octahydroxy-15,16,18-trimethyl-13-oxo-14,39-dioxabicyclo[33.3.1]nonatriaconta-19,21,23,25,27,29,31-heptaene-36-carboxamide

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
177551342
SMILES
B1(C2=C(CO1)C=CC(=C2)CN[C@H]3[C@@H]([C@H](O[C@H]([C@H]3O)O[C@@H]4C[C@H]5[C@@H]([C@H](C[C@](O5)(C[C@H](C[C@H]([C@@H](CC[C@H](C[C@H](CC(=O)O[C@H]([C@@H]([C@@H]([C@H](C=CC=CC=CC=CC=CC=CC=C4)C)O)C)C)O)O)O)O)O)O)O)C(=O)NCCN(C)C)C)O)O
Canonical SMILES
C[C@@H]1[C@H](O)[C@@H](C)C=CC=CC=CC=CC=CC=CC=C[C@H](O[C@@H]2O[C@H](C)[C@@H](O)[C@H](NCc3ccc4c(c3)B(O)OC4)[C@@H]2O)C[C@@H]2O[C@](O)(C[C@@H](O)C[C@@H](O)[C@H](O)CC[C@@H](O)C[C@@H](O)CC(=O)O[C@H]1C)C[C@H](O)[C@H]2C(=O)NCCN(C)C

名称与同义词

  • J3.543.147K
  • (1R,3S,5R,6R,9R,11R,15S,16R,17R,18S,23Z,33R,35S,36R,37S)-33-{[(2R,3S,4S,5S,6R)-3,5-dihydroxy-4-{[(1-hydroxy-1,3-dihydro-2,1-benzoxaborol-6-yl)methyl]amino}-6-methyloxan-2-yl]oxy}-N-[2-(dimethylamino)ethyl]-1,3,5,6,9,11,17,37-octahydroxy-15,16,18-trimethyl-13-oxo-14,39-dioxabicyclo[33.3.1]nonatriaconta-19,21,23,25,27,29,31-heptaene-36-carboxamide
  • 16-Decarboxy-16-[[2-(dimethylamino)ethyl]carbamoyl]-3-N -[(1-hydroxy-1,3-dihydro-2,1-benzooxaborol-6-yl)methyl]Amphotericin B ester