Bilirubin (data page)

OrganicBox complete
wiki_name=Bilirubin
name=3- [2- [(3-(2-carboxyethyl)-5- [(3-ethenyl-4-methyl-5-oxo-pyrrol-2-ylidene)methyl] -
4-methyl-1H-pyrrol-2-yl] methyl)-5- [(4-ethenyl-3-methyl-5-oxo-pyrrol-2-ylidene)
methyl] -4-methyl-1H-pyrrol-3-yl] propanoic acid
= GENERAL INFORMATION =

C=33 | H=36 | N=4 | O=6
mass=584.662
abbreviation=


synonyms=Pheophytin
= DATABASES =

SMILES=CC1=C(NC(=C1CCC(=O)O)CC2=C(C(=C(N2)C=C3C(=C(C(=O)N3)C)C=C)C)CCC(=O)O)C=C4C(=C(C(=O)N4)C=C)C
InChI=1/C33H36N4O6/c1-7-20-19(6)32(42)37-27(20)14-25-18(5)23(10-12-31(40)41)29(35-25)15-28-22(9-11-30(38)39)17(4)24(34-28)13-26-16(3)21(8-2)33(43)36-26/h7-
8,13-14,34-35H,1-2,9-12,15H2,3-6H3,(H,36,43)(H,37,42)(H,38,39)(H,40,41)/f/h36-38,40H
CAS=
DrugBank=
EINECS=
PubChem=250 ref_N|1|a
= PHYSICAL PROPERTIES =

--------------- Structure -------------
index_of_refraction=
abbe_number=
dielectric_constant=
magnetic_susceptibility=
dipole_moment=
------------- U-V data --------------
lambda_max=
extinction_coefficient=
------------- Infrared data --------------
absorption_bands=
------------- NMR data --------------
proton_NMR=
carbon_NMR=
other_NMR=
------------- Spectrometry data --------------
mass_spectrometry=
-------- Phase behaviour -------
delta_fus_H_o=
delta_fus_S_o=
delta_vap_H_o=
delta_vap_S_o=
triple_point_K=
triple_point_C=
triple_point_Pa=
criticle_point_K=
criticle_point_C=
criticle_point_Pa=
------- Solid properties -------
delta_f_H_o_solid=
S_o_solid=
heat_capacity_solid=
density_solid=
melting_point_C=
melting_point_F=
melting_point_K=
------- Liquid properties -------
delta_f_H_o_liquid=
S_o_liquid=
heat_capacity_liquid=
density_liquid=
viscosity_liquid=
boiling_point_C=
boiling_point_F=
boiling_point_K=
------------- Gas properties --------------
delta_f_H_o_gas=
S_o_gas=
heat_capacity_gas=
viscosity_gas=
= HAZARD PROPERTIES =

MSDS=
main_hazards=
nfpa_health=
nfpa_flammability=
nfpa_reactivity=
nfpa_special=
flash_point=
r_phrases=
s_phrases=
RTECS_number=
= CHEMICAL PROPERTIES =

XLogP=1.9
isoelectric_point=
disociation_constant=
tautomers=25
H_bond_donor=6
H_bond_acceptor=8
= PHARMACOLOGICAL PROPERTIES =

References

#note_N|1|a PubChem|250