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Substance Name: Daptomycin [USAN:INN:BAN]
RN: 103060-53-3
UNII: NWQ5N31VKK
InChIKey: DOAKLVKFURWEDJ-QCMAZARJSA-N

Note

  • A cyclic lipopeptide antibiotic that inhibits gram-positive bacteria.

Molecular Formula

  • C72-H101-N17-O26

Molecular Weight

  • 1620.6829
 

Classification Codes

  • Anti-Bacterial Agents
  • Anti-Infective Agents
  • Antibacterial

Names and Synonyms

Name of Substance

  • Daptomycin
  • Daptomycin [USAN:INN:BAN]

MeSH Heading

  • Daptomycin

Synonyms

  • Cidecin
  • Cubicin
  • Cubicin Rf
  • Daptomicina
  • Daptomicina [Spanish]
  • Daptomycin
  • Daptomycin for injection
  • Daptomycine
  • Daptomycine [French]
  • Daptomycinum
  • Daptomycinum [Latin]
  • Deptomycin
  • LY 146032
  • LY-146032
  • LY146032
  • N-Decanoyl-L-tryptophyl-L-asparaginyl-L-aspartyl-L-threonylglycyl-L-ornithyl-L-aspartyl-D-alanyl-L-aspartylglycyl-D-seryl-threo-3-methyl-L-glutamyl-3-anthraniloyl-L-alanine epsilon1-lactone
  • UNII-NWQ5N31VKK

Systematic Name

  • Daptomycin

Registry Numbers

CAS Registry Number

  • 103060-53-3

FDA UNII

  • NWQ5N31VKK

System Generated Number

  • 0103060533

Structure Descriptors

InChI

1S/C72H101N17O26/c1-5-6-7-8-9-10-11-22-53(93)81-44(25-38-31-76-42-20-15-13-17-39(38)42)66(108)84-45(27-52(75)92)67(109)86-48(30-59(102)103)68(110)89-61-37(4)115-72(114)49(26-51(91)40-18-12-14-19-41(40)74)87-71(113)60(35(2)24-56(96)97)88-69(111)50(34-90)82-55(95)32-77-63(105)46(28-57(98)99)83-62(104)36(3)79-65(107)47(29-58(100)101)85-64(106)43(21-16-23-73)80-54(94)33-78-70(61)112/h12-15,17-20,31,35-37,43-50,60-61,76,90H,5-11,16,21-30,32-34,73-74H2,1-4H3,(H2,75,92)(H,77,105)(H,78,112)(H,79,107)(H,80,94)(H,81,93)(H,82,95)(H,83,104)(H,84,108)(H,85,106)(H,86,109)(H,87,113)(H,88,111)(H,89,110)(H,96,97)(H,98,99)(H,100,101)(H,102,103)/t35-,36-,37-,43+,44+,45-,46+,47+,48+,49+,50-,60+,61+/m1/s1

InChIKey

DOAKLVKFURWEDJ-QCMAZARJSA-N

Smiles

CCCCCCCCCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](CC(=O)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H]3[C@@H](C)OC(=O)[C@H](CC(=O)c4ccccc4N)NC(=O)[C@@H](NC(=O)[C@@H](CO)NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCN)NC(=O)CNC3=O)[C@H](C)CC(=O)O