Feedback

(3Z)-phytochromobilin

Properties

Image

Occurences in reactions

MNX_ID

MNXM733867

	#reac
in my sandbox	0
in MNXref (generic)	9
in models (compartimentalized)	2

formula

C₃₃H₃₄N₄O₆

charge

-2

mass

582.24893

reference

chebi:57439

InChIKey

DKMLMZVDTGOEGU-AIKFXVFZSA-L

InChI

InChI=1S/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/h7-8,13-15,19,35H,2,9-12H2,1,3-6H3,(H,36,43)(H,37,42)(H,38,39)(H,40,41)/p-2/b20-7-,26-13-,27-14-,28-15-/t19-/m1/s1

SMILES

C=CC1=C(C)/C(=C/C2=N/C(=C\c3[nH]c(/C=C4\NC(=O)[C@H](C)\C4=C/C)c(C)c3CCC(=O)[O-])C(CCC(=O)[O-])=C2C)NC1=O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:57439 chebi:57439	(3Z)-phytochromobilin (3Z)-phytochromobilin(2-) 3-(2-[(Z)-{3-(2-carboxylatoethyl)-5-[(Z)-(4-ethenyl-3-methyl-5-oxo-1,5-dihydro-2H-pyrrol-2-ylidene)methyl]-4-methyl-2H-pyrrol-2-ylidene}methyl]-5-{(Z)-[(3Z,4R)-3-ethylidene-4-methyl-5-oxopyrrolidin-2-ylidene]methyl}-4-methyl-1H-pyrrol-3-yl)propanoate
kegg.compound:C05913 keggC:C05913	(3Z)-Phytochromobilin
seed.compound:cpd03509 seedM:cpd03509	(3Z)-Phytochromobilin (3Z)-phytochromobilin
metacyc.compound:3Z-PHYTOCHROMOBILIN metacycM:3Z-PHYTOCHROMOBILIN	(3Z)-phytochromobilin
CHEBI:15619 chebi:15619	(3Z)-phytochromobilin (3Z)-Phytochromobilin 3-(2-[(Z)-{3-(2-carboxyethyl)-5-[(Z)-(4-ethenyl-3-methyl-5-oxo-1,5-dihydro-2H-pyrrol-2-ylidene)methyl]-4-methyl-2H-pyrrol-2-ylidene}methyl]-5-{(Z)-[(3Z,4R)-3-ethylidene-4-methyl-5-oxopyrrolidin-2-ylidene]methyl}-4-methyl-1H-pyrrol-3-yl)propanoic acid
chebi:10897 chebi:225 keggC:M_C05913 seedM:M_cpd03509	secondary/obsolete/fantasy identifier