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CHEBI:51832 - ATTO 635-7

ChEBI IDCHEBI:51832
ChEBI NameATTO 635-7
Stars
Last Modified10 February 2009
SubmitterInma Spiteri
DownloadsMolfile
FormulaC43H61N6O3S.ClO4
Net Charge0
Average Mass841.516
Monoisotopic Mass840.40110
SMILESCC1=CC(C)(C)[N+](CCCC(=O)NCCCCCNC(=O)CCCCC2SCC3NC(=O)NC32)=c2cc3c(cc21)=Cc1ccc(N(C)C)cc1C3(C)C.O=Cl(=O)(=O)[O-]
InChIInChI=1S/C43H60N6O3S.ClHO4/c1-28-26-42(2,3)49(36-25-34-30(23-32(28)36)22-29-17-18-31(48(6)7)24-33(29)43(34,4)5)21-13-16-39(51)45-20-12-8-11-19-44-38(50)15-10-9-14-37-40-35(27-53-37)46-41(52)47-40;2-1(3,4)5/h17-18,22-26,35,37,40H,8-16,19-21,27H2,1-7H3,(H3-,44,45,46,47,50,51,52);(H,2,3,4,5)
InChIKeyVNVBFUFXPWMSGY-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
ATTO 635-7 (CHEBI:51832) has functional parent ATTO 635-2 (CHEBI:51829)
ATTO 635-7 (CHEBI:51832) is a thiabicycloalkane (CHEBI:38297)
IUPAC Name 
9-(dimethylamino)-2,2,4,11,11-pentamethyl-1-{4-oxo-4-[(5-{[5-(2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanoyl]amino}pentyl)amino]butyl}-2,11-dihydronaphtho[2,3-g]quinolinium perchlorate
Synonym  Source
ATTO 635 biotin derivativeChEBI