Search MNXref
 Feedback

2'-deamino-2'-hydroxy-6'-dehydroparomamine

PropertiesImage
MNX_IDMNXM97123 Image of MNXM97123
referencechebi:67214
formulaC12H24N2O8
global charge2
mol weight324.33
InChIKeyNINNJPOSRPHVPI-JCLMPDJQSA-P
InChIInChI=1S/C12H22N2O8/c13-3-1-4(14)11(9(19)6(3)16)22-12-10(20)8(18)7(17)5(2-15)21-12/h2-12,16-20H,1,13-14H2/p+2/t3-,4+,5-,6+,7-,8+,9-,10-,11-,12-/m1/s1
SMILES[NH3+][C@@H]1C[C@H]([NH3+])[C@@H](O[C@H]2O[C@H](C=O)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O
MNX internals
InChI (mnx)InChI=1/C12H22N2O8/c13-3-1-4(14)11(9(19)6(3)16)22-12-10(20)8(18)7(17)5(2-15)21-12/h2-12,16-20H,1,13-14H2/t3-,4+,5-,6+,7-,8+,9-,10-,11-,12-/m1/s1 Image of MNXM97123
SMILES (mnx)[CH2:1]1[C@@H:3]([NH2:13])[C@H:6]([OH:16])[C@@H:9]([OH:19])[C@H:11]([O:22][C@@H:12]2[C@H:10]([OH:20])[C@@H:8]([OH:18])[C@H:7]([OH:17])[C@@H:5]([CH:2]=[O:15])[O:21]2)[C@H:4]1[NH2:14]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:67214
chebi:67214
NINNJPOSRPHVPI-JCLMPDJQSA-P 		2'-deamino-2'-hydroxy-6'-dehydroparomamine
(1R,3S,4R,5R,6S)-4-(alpha-D-gluco-hexodialdo-1,5-pyranosyloxy)-5,6-dihydroxycyclohexane-1,3-diaminium
2'-deamino-2'-hydroxy-6'-dehydroparomamine(2+)

kegg.compound:C20351
keggC:C20351
NINNJPOSRPHVPI-JCLMPDJQSA-N 		2'-Deamino-2'-hydroxy-6'-dehydroparomamine

metacyc.compound:CPD-14156
metacycM:CPD-14156
NINNJPOSRPHVPI-JCLMPDJQSA-P 		2'-deamino-2'-hydroxy-6'-dehydroparomamine

CHEBI:67225
chebi:67225
NINNJPOSRPHVPI-JCLMPDJQSA-N 		2'-deamino-2'-hydroxy-6'-dehydroparomamine
(1R,2R,3S,4R,6S)-4,6-diamino-2,3-dihydroxycyclohexyl alpha-D-gluco-hexodialdo-1,5-pyranoside

seed.compound:cpd24204
seedM:cpd24204
NINNJPOSRPHVPI-JCLMPDJQSA-P 		2'-deamino-2'-hydroxy-6'-oxoparomamine
2'-Deamino-2'-hydroxy-6'-dehydroparomamine
2'-deamino-2'-hydroxy-6'-dehydroparomamine

keggC:M_C20351
seedM:M_cpd24204 		secondary/obsolete/fantasy identifier