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Substance Name: Indocyanine green acid form
RN: 28782-33-4
UNII: C4V974V932
InChIKey: BDBMLMBYCXNVMC-UHFFFAOYSA-N

Molecular Weight

  • 752.9922
 
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Names and Synonyms

Name of Substance

  • Indocyanine green acid form

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-heptatrien-1-yl)-1,1-dimethyl-3-(4-sulfobutyl)-, inner salt
  • Crysta-lyn 551522
  • NK 5078
  • NK-5078
  • UNII-C4V974V932

Registry Numbers

CAS Registry Number

  • 28782-33-4

FDA UNII

  • C4V974V932

System Generated Number

  • 0028782334

Structure Descriptors

InChI

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)

InChIKey

BDBMLMBYCXNVMC-UHFFFAOYSA-N

Smiles

CC1(c2c3ccccc3ccc2[N+](=C1C=CC=CC=CC=C4C(c5c6ccccc6ccc5N4CCCCS(=O)(=O)O)(C)C)CCCCS(=O)(=O)[O-])C