Search MNXref
 Feedback

gentamycin C1

MNXM54878 is deprecated and here replaced by MNXM738022
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM738022 Image of MNXM738022
referencechebi:27412
formulaC21H43N5O7
global charge0
mol weight477.603
InChIKeyCEAZRRDELHUEMR-URQXQFDESA-N
InChIInChI=1S/C21H43N5O7/c1-9(25-3)13-6-5-10(22)19(31-13)32-16-11(23)7-12(24)17(14(16)27)33-20-15(28)18(26-4)21(2,29)8-30-20/h9-20,25-29H,5-8,22-24H2,1-4H3/t9?,10-,11+,12-,13+,14+,15-,16-,17+,18-,19-,20-,21+/m1/s1
SMILESCNC(C)[C@@H]1CC[C@@H](N)[C@@H](O[C@H]2[C@H](O)[C@@H](O[C@H]3OC[C@](C)(O)[C@H](NC)[C@H]3O)[C@H](N)C[C@@H]2N)O1
MNX internals
InChI (mnx)InChI=1/C21H43N5O7/c1-9(25-3)13-6-5-10(22)19(31-13)32-16-11(23)7-12(24)17(14(16)27)33-20-15(28)18(26-4)21(2,29)8-30-20/h9-20,25-29H,5-8,22-24H2,1-4H3/t9?,10-,11+,12-,13+,14+,15-,16-,17+,18-,19-,20-,21+/m1/s1 Image of MNXM738022
SMILES (mnx)[CH3:1][CH:9]([C@@H:13]1[CH2:6][CH2:5][C@@H:10]([NH2:22])[C@@H:19]([O:32][C@@H:16]2[C@@H:11]([NH2:23])[CH2:7][C@@H:12]([NH2:24])[C@H:17]([O:33][C@@H:20]3[C@H:15]([OH:28])[C@@H:18]([NH:26][CH3:4])[C@@:21]([CH3:2])([OH:29])[CH2:8][O:30]3)[C@H:14]2[OH:27])[O:31]1)[NH:25][CH3:3]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:27412
chebi:27412
CEAZRRDELHUEMR-URQXQFDESA-N 		gentamycin C1
(1R,2S,3S,4R,6S)-4,6-diamino-3-[3-deoxy-4-C-methyl-3-(methylamino)-beta-L-arabinopyranosyloxy]-2-hydroxycyclohexyl 2-amino-2,3,4,6,7-pentadeoxy-6-(methylamino)-beta-L-lyxo-heptopyranoside
Gentamicin C1
O-2-amino-2,3,4,6,7-pentadeoxy-6-(methylamino)-alpha-D-ribo-heptopyranosyl-(1-4)-O-(3-deoxy-4-C-methyl-3-(methylamino)-beta-L-arabinopyranosyl-(1-6))-2-deoxy-D-streptamine

sabiork.compound:9760
sabiorkM:9760
CEAZRRDELHUEMR-URQXQFDESA-N 		Gentamicin C1

chebi:24209
chebi:5309 		secondary/obsolete/fantasy identifier