|
|
Substance Name: Indocyanine green [USP:JAN]
RN: 3599-32-4
UNII: IX6J1063HV
InChIKey: MOFVSTNWEDAEEK-UHFFFAOYSA-M
Note
- A tricarbocyanine dye that is used diagnostically in liver function tests and to determine blood volume and cardiac output.
Molecular Formulas
- C43-H47-N2-Na-O6-S2
- C43-H48-N2-O6-S2.Na
Molecular Weight
- 774.974
- All
- Classifications
- Links to Resources
- Names & Synonyms
- Registry Numbers
- Formulas
- Structure Descriptors
- Toxicity
- Physical Properties
Classification Codes
- Coloring Agents
- Diagnostic Aid (Cardiac Output Determination)
- Diagnostic Aid (Hepatic Function Determination)
- Drug / Therapeutic Agent
* denotes mobile formatted website
Links to Resources
NLM Resources (File Locators)
Regulatory Agencies (Superlist Locators)
Other Resources (Internet Locators)
Search for this InChIKey on the Web
Names and Synonyms
Name of Substance
- Indocyanine Green
- Indocyanine green [USP:JAN]
MeSH Heading
- Indocyanine Green
Synonyms
- 1H-Benz(e)indolium, 2-(7-(1,3-dihydro-1,1-dimethyl-3-(4-sulfobutyl)-2H-benz(e)indol-2-ylidene)-1,3,5-heptatrienyl)-1,1-dimethyl-3-(4-sulfobutyl)-, hydroxide, inner salt, sodium salt
- 2-(7-(1,1-Dimethyl-3-(4-sulfobutyl)benz(e)indolin-2-ylidene)-1,3,5-heptatrienyl)-1,1-dimethyl-3-(4-sulfobutyl)-1H-benz(e)indolium hydroxide, inner salt, sodium salt
- 2-(7-(1,3-Dihydro-1,1-dimethyl-3-(4-sulfobutyl)benz(e)indolin-2-ylidene)-1,3,5-heptatrienyl)-1,1-dimethyl-3-(4-sulfobutyl)-1H-benz(e)indoliumhydroxide inner sodium salt
- Anhydro-3,3,3',3'-tetramethyl-1,1'-bis(4-sulfobutyl)-4,5,4',5'-dibenzoindotricarbocyanine hydroxide inner salt sodium salt
- Cardio-Green
- EINECS 222-751-5
- Fox Green
- HSDB 3413
- HWD Indocyanine Green
- IC-Green
- ICG
- Indocyanine Green
- IR 125
- Natrium 4-(2-(7-(2,3-Dihydro-1,1-dimethyl-3-(4-sulfobutyl)-1H-benz(e)indol-2-yliden)-1,3,5-heptatrienyl)-1,1-dimethyl-1H-benz(e)indol-3-ol)butan-1-sulfonat
- NK 1611
- Ujoviridin
- UNII-IX6J1063HV
- Wofaverdin
Systematic Names
- 1H-Benz(e)indolium, 2-(7-(1,3-dihydro-1,1-dimethyl-3-(4-sulfobutyl)-2H-benz(e)indol-2-ylidene)-1,3,5-heptatrien-1-yl)-1,1-dimethyl-3-(4-sulfobutyl)-, inner salt, sodium salt (1:1)
- 1H-Benz(e)indolium, 2-(7-(1,3-dihydro-1,1-dimethyl-3-(4-sulfobutyl)-2H-benz(e)indol-2-ylidene)-1,3,5-heptatrienyl)-1,1-dimethyl-3-(4-sulfobutyl)-, hydroxide, inner salt, sodium salt
- 1H-Benz(e)indolium, 2-(7-(1,3-dihydro-1,1-dimethyl-3-(4-sulfobutyl)-2H-benz(e)indol-2-ylidene)-1,3,5-heptatrienyl)-1,1-dimethyl-3-(4-sulfobutyl)-, inner salt, sodium salt
- Sucrose, crude (cane sugar)
Registry Numbers
CAS Registry Number
- 3599-32-4
FDA UNII
- IX6J1063HV
Other Registry Numbers
- 1814902-08-3
- 58984-23-9
System Generated Number
- 0003599324
Molecular Formulas
Molecular Formulas
- C43-H47-N2-Na-O6-S2
- C43-H48-N2-O6-S2.Na
Molecular Formula Fragments
- C43-H48-N2-O6-S2
- COMPONENT
- Na
Structure Descriptors
InChI
InChI=1S/C43H48N2O6S2.Na/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);/q;+1/p-1InChIKey
MOFVSTNWEDAEEK-UHFFFAOYSA-MSmiles
[Na+].CC1(C)Toxicity
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | intravenous | 60mg/kg (60mg/kg) | Toxicology and Applied Pharmacology. Vol. 44, Pg. 225, 1978. | |
rat | LD50 | intravenous | 87mg/kg (87mg/kg) | Drugs in Japan Vol. -, Pg. 189, 1995. |
Physical Properties
Physical Property | Value | Units | Temp (deg C) | Source |
---|---|---|---|---|
log P (octanol-water) | -0.29 | (none) | EXP | |
Atmospheric OH Rate Constant | 3.19E-10 | cm3/molecule-sec | 25 | EST |
Physical property data is provided to ChemIDplus by SRC, Inc.