C88H100Cl2N10O28
1816.7 g/mol
원료의약품경고
Dalbavancin
CAS171500-79-1
용도 분류
원료의약품
화합물 분류
펩타이드
주요 용도
의약 원료
Dalbavancin is a lipoglycopeptide antibacterial active pharmaceutical ingredient. It is a derivative of A-40926 and interferes with peptidoglycan synthesis, making it a compound used in pharmaceutical manufacturing.
Pharmaceutical raw material for antibacterial drug productsLipoglycopeptide antibiotic compound for research and development
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CAS 171500-79-1
관련 화합물
안전 참조
경고
H361Suspected of damaging fertility or the unborn child
H373May cause damage to organs through prolonged or repeated exposure
H400Very toxic to aquatic life
H410Very toxic to aquatic life with long lasting effects
식별자
IUPAC 이름
(2S,3S,4R,5R,6S)-6-[[(1S,2R,19R,22R,34S,37R,40R,52S)-5,32-dichloro-52-[3-(dimethylamino)propylcarbamoyl]-2,26,31,44,49-pentahydroxy-22-(methylamino)-21,35,38,54,56,59-hexaoxo-47-[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-7,13,28-trioxa-20,36,39,53,55,58-hexazaundecacyclo[38.14.2.23,6.214,17.219,34.18,12.123,27.129,33.141,45.010,37.046,51]hexahexaconta-3,5,8,10,12(64),14(63),15,17(62),23(61),24,26,29(60),30,32,41(57),42,44,46(51),47,49,65-henicosaen-64-yl]oxy]-3,4-dihydroxy-5-(10-methylundecanoylamino)oxane-2-carboxylic acid
InChIKey
KGPGQDLTDHGEGT-SZUNQUCBSA-N
SMILES
CC(C)CCCCCCCCC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@H]1OC2=C3C=C4C=C2OC5=C(C=C(C=C5)[C@H]([C@H]6C(=O)N[C@@H](C7=C(C(=CC(=C7)O)O[C@@H]8[C@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O)C9=C(C=CC(=C9)[C@H](C(=O)N6)NC(=O)[C@@H]4NC(=O)[C@@H]1C2=C(C(=CC(=C2)OC2=C(C=CC(=C2)[C@H](C(=O)N[C@H](CC2=CC=C(O3)C=C2)C(=O)N1)NC)O)O)Cl)O)C(=O)NCCCN(C)C)O)Cl)C(=O)O)O)O
동의어 목록 (15)
- A-A-1
- Dalbavancin
- Dalbavancin Impurity 24
- Dalbavancina
- Dalvance
- MDL 63,397
- MDL 64,397
- Zeven
- dalbavancin B0
- dalbavancine
- dalbavancinum