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pheophytin a

MNXM75042 is deprecated and here replaced by MNXM1093999
!!! Alternative mappings exist !!!
PropertiesImageOccurences in reactions
MNX_IDMNXM1093999Image of MNXM1093999
#reac
in my sandbox 0
in MNXref (generic)5
in models (compartimentalized) 0
formulaC55H74N4O5
charge0
mass870.56592
referencechebi:44898
InChIKeyCQIKWXUXPNUNDV-RCBXBCQGSA-N
InChIInChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,56,59H,1,14-25,27H2,2-12H3/b34-26+,42-28-,43-29-,44-28-,45-30-,46-29-,47-30-,52-50-/t32-,33-,37+,41+,51-/m1/s1
SMILESC=Cc1c(C)c2cc3nc(c4c5[nH]c(cc6nc(cc1[nH]2)C(C)=C6CC)c(C)c5C(=O)[C@@H]4C(=O)OC)[C@@H](CCC(=O)OC/C=C(\C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)[C@@H]3C
Parent-child relations graph
 Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
CHEBI:44898
chebi:44898 		pheophytin a
PHEOPHYTIN A
Phaeophytin-a
methyl (3S,4S,21R)-14-ethyl-4,8,13,18-tetramethyl-20-oxo-3-(3-oxo-3-{[(2E,7R,11R)-3,7,11,15-tetramethylhexadec-2-en-1-yl]oxy}propyl)-9-vinylphorbine-21-carboxylate
phaeophytin a
bigg.metabolite:phptna
biggM:phptna
kegg.compound:C05797
keggC:C05797 		Pheophytin a
metacyc.compound:CPD-8155
metacycM:CPD-8155 		pheophytin a
chebi:38255
chebi:44895
biggM:M_phptna
keggC:M_C05797 		secondary/obsolete/fantasy identifier