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CHEBI:749407 - indocyanine green acid form

Default Structure
ChEBI IDCHEBI:749407
ChEBI Nameindocyanine green acid form
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC43H48N2O6S2
Net Charge0
Average Mass752.999
Monoisotopic Mass752.29538
SMILESCC1(C)C(/C=C/C=C/C=C/C=C2\N(CCCCS(=O)(=O)O)c3ccc4ccccc4c3C2(C)C)=[N+](CCCCS(=O)(=O)[O-])c2ccc3ccccc3c21
InChIInChI=1S/C43H48N2O6S2/c1-42(2)38(44(28-14-16-30-52(46,47)48)36-26-24-32-18-10-12-20-34(32)40(36)42)22-8-6-5-7-9-23-39-43(3,4)41-35-21-13-11-19-33(35)25-27-37(41)45(39)29-15-17-31-53(49,50)51/h5-13,18-27H,14-17,28-31H2,1-4H3,(H-,46,47,48,49,50,51)
InChIKeyBDBMLMBYCXNVMC-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
indocyanine green acid form (CHEBI:749407) is a naphthalenes (CHEBI:25477)
Synonyms  Source
Crysta-lyn 551522ChEMBL
Indocyanine green acid formChEMBL
NK 5078ChEMBL
NK-5078ChEMBL
Citations