Primary Record
J1.708.638C
- In stock
- 550 g
- Purity
- 98.1 %
Compound Identifiers & Properties
- PubChem CID
- 177580716
- SMILES
- C[C@H]1[C@H]([C@@](CC(O1)O[C@@H]2[C@H]([C@@H]([C@H](O[C@H]2OC3=C4C=C5C=C3OC6=C(C=C(C=C6)[C@H]([C@H](C(=O)N[C@H](C(=O)N[C@H]5C(=O)N[C@@H]7C8=CC(=C(C=C8)O)C9=C(C=C(C=C9O)O)[C@H](NC(=O)[C@H]([C@@H](C1=CC(=C(O4)C=C1)Cl)O)NC7=O)C(=O)O)CC(=O)N)NC(=O)[C@@H](CC(C)C)NC)O)Cl)CN(C)C)O)O)(C)NCC1=CC=C(C=C1)COC1=CC(=C(C=C1)Cl)Cl)O
- Canonical SMILES
- CN[C@H](CC(C)C)C(=O)N[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H]2C(=O)N[C@H]3C(=O)N[C@H](C(=O)N[C@H](C(=O)O)c4cc(O)cc(O)c4-c4cc3ccc4O)[C@H](O)c3ccc(c(Cl)c3)Oc3cc2cc(c3O[C@@H]2O[C@H](CN(C)C)[C@@H](O)[C@H](O)[C@H]2OC2C[C@](C)(NCc3ccc(COc4ccc(Cl)c(Cl)c4)cc3)[C@H](O)[C@H](C)O2)Oc2ccc(cc2Cl)[C@H]1O
Names & Synonyms
- J1.708.638C
- (1S,2R,18R,19R,22S,25R,28R,40S)-22-(carbamoylmethyl)-47,49-dichloro-48-{[(2S,3R,4S,5S,6R)-3-{[(4S,5S,6S)-4-[({4-[(3,4-dichlorophenoxy)methyl]phenyl}methyl)amino]-5-hydroxy-4,6-dimethyloxan-2-yl]oxy}-6-[(dimethylamino)methyl]-4,5-dihydroxyoxan-2-yl]oxy}-2,18,32,35,37-pentahydroxy-19-[(2R)-4-methyl-2-(methylamino)pentanamido]-20,23,26,42,44-pentaoxo-7,13-dioxa-21,24,27,41,43-pentaazaoctacyclo[26.14.2.23,6.214,17.18,12.129,33.010,25.034,39]pentaconta-3,5,8(48),9,11,14,16,29,31,33(45),34,36,38,46,49-pentadecaene-40-carboxylic acid
- 44-O-[2-O-[3-[4-(3,4-Dichlorophenoxymethyl)benzylamino]-3-methyl-2,3,6-trideoxy-L-lyxo-hexopyranosyl]-6-(dimethylamino)-6-deoxy-beta-D-glucopyranosyl]-44-O-des[2-O-(3-amino-3-methyl-2,3,6-trideoxy-L-lyxo-hexopyranosyl)-beta-D-glucopyranosyl]vancomycin