OntologieschebiclassesCHEBI:52935   
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X-rhod-1(1+)
http://purl.obolibrary.org/obo/CHEBI_52935

A cationic fluorescent dye derived from a xanthene-based heteroheptacycle.

Also appears inslm
Exact Synonyms
9-(4-{bis[2-(acetyloxymethoxy)-2-oxoethyl]amino}-3-[2-(2-{bis[2-(acetyloxymethoxy)-2-oxoethyl]amino}-5-methylphenoxy)ethoxy]phenyl)-2,3,6,7,12,13,16,17-octahydro-1H,5H,11H,15H-pyrido[3,2,1-ij]quinolizino[1',9':6,7,8]chromeno[2,3-f]quinolin-4-ium
Related Synonyms
X-rhod-1 cation
class Information
charge

+1

formula

C60H67N4O19

has_obo_namespace

chebi_ontology

inchi

InChI=1S/C60H67N4O19/c1-36-14-16-48(63(28-52(69)79-32-75-37(2)65)29-53(70)80-33-76-38(3)66)50(24-36)73-22-23-74-51-27-41(15-17-49(51)64(30-54(71)81-34-77-39(4)67)31-55(72)82-35-78-40(5)68)56-46-25-42-10-6-18-61-20-8-12-44(57(42)61)59(46)83-60-45-13-9-21-62-19-7-11-43(58(45)62)26-47(56)60/h14-17,24-27H,6-13,18-23,28-35H2,1-5H3/q+1

inchikey

KWRLHAISDKTMGD-UHFFFAOYSA-N

in_subset

3_STAR

mass

1148.18940

monoisotopicmass

1147.43940

smiles

CC(=O)OCOC(=O)CN(CC(=O)OCOC(C)=O)c1ccc(C)cc1OCCOc1cc(ccc1N(CC(=O)OCOC(C)=O)CC(=O)OCOC(C)=O)C1=c2cc3CCC[N+]4=c3c(CCC4)c2Oc2c3CCCN4CCCc(cc12)c34

class Relations