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Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks
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coenzyme alpha-F420-3
Properties
Image
Occurences in reactions
MNX_ID
MNXM1379956
#reac
in my sandbox
0
in MNXref (generic)
1
in models (compartimentalized)
0
formula
C
34
H
38
N
6
O
21
P
charge
-5
mass
897.672
reference
seedM:cpd24803
InChIKey
BPEXVIBPGLCTOM-LROHGRLLSA-I
InChI
InChI=1S/C34H43N6O21P/c1-14(29(50)36-19(32(53)54)4-7-24(44)35-18(5-8-25(45)46)31(52)37-20(33(55)56)6-9-26(47)48)61-62(58,59)60-13-23(43)27(49)22(42)12-40-21-11-16(41)3-2-15(21)10-17-28(40)38-34(57)39-30(17)51/h2-3,10-11,14,18-20,22-23,27,41-43,49H,4-9,12-13H2,1H3,(H,35,44)(H,36,50)(H,37,52)(H,45,46)(H,47,48)(H,53,54)(H,55,56)(H,58,59)(H,39,51,57)/p-5/t14-,18-,19-,20-,22-,23+,27-/m0/s1
SMILES
[CH3:1][C@@H:14]([C:29](=[N:36][C@@H:19]([CH2:4][CH2:7][C:24](=[N:35][C@@H:18]([CH2:5][CH2:8][C:25](=[O:45])[OH:46])[C:31](=[N:37][C@@H:20]([CH2:6][CH2:9][C:26](=[O:47])[OH:48])[C:33](=[O:55])[OH:56])[OH:52])[OH:44])[C:32](=[O:53])[OH:54])[OH:50])[O:61][P:62]([OH:58])(=[O:59])[O:60][CH2:13][C@H:23]([C@H:27]([C@H:22]([CH2:12][n:40]1[c:21]2[cH:11][c:16]([OH:41])[cH:3][cH:2][c:15]2[cH:10][c:17]2[c:30]([OH:51])[n:39][c:34](=[O:57])[n:38][c:28]1-2)[OH:42])[OH:49])[OH:43]
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
Identifier
Description
seed.compound:cpd24803
seedM:cpd24803
coenzyme alpha-F420-3
seedM:M_cpd24803
secondary/obsolete/fantasy identifier