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rifamycin-undecaketide carboxy group(1-)

PropertiesImage
MNX_IDMNXM160850 Image of MNXM160850
referencechebi:71973
formulaC35H47NO10*
global charge-1
mol weight 
InChIKey 
InChI 
SMILES[*]C(=O)/C(C)=C/C=C/[C@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)C(C)/C=C(\C)C(=O)C1=C([O-])C(C)C(O)C2=C1C(=O)C=C(N)C2=O
MNX internals
InChI (mnx)InChI=1/C36H51NO10/c1-15(23(9)38)11-10-12-16(2)29(40)19(5)32(43)21(7)33(44)20(6)30(41)17(3)13-18(4)31(42)27-26-25(39)14-24(37)36(47)28(26)35(46)22(8)34(27)45/h10-14,16-17,19-22,29-30,32-33,35,40-41,43-46H,37H2,1-9H3/b12-10+,15-11+,18-13+/t16-,17?,19+,20+,21+,22?,29-,30-,32+,33+,35?/m0/s1/i9+1 Image of MNXM160850
SMILES (mnx)[CH3:1]/[C:15](=[CH:11]\[CH:10]=[CH:12]\[C@H:16]([CH3:2])[C@@H:29]([C@@H:19]([CH3:5])[C@H:32]([C@@H:21]([CH3:7])[C@@H:33]([C@H:20]([CH3:6])[C@H:30]([CH:17]([CH3:3])/[CH:13]=[C:18](\[CH3:4])[C:31]([C:27]1=[C:34]([OH:45])[CH:22]([CH3:8])[CH:35]([OH:46])[C:28]2=[C:26]1[C:25](=[O:39])[CH:14]=[C:24]([NH2:37])[C:36]2=[O:47])=[O:42])[OH:41])[OH:44])[OH:43])[OH:40])[C:23]([13CH3:9])=[O:38]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:71973
chebi:71973 		rifamycin-undecaketide carboxy group(1-)
(2E,4E,6S,7S,8R,9R,10R,11R,12R,13S,15E)-17-(6-amino-2,4-dihydroxy-3-methyl-5,8-dioxo-3,4,5,8-tetrahydronaphthalen-1-yl)-7,9,11,13-tetrahydroxy-2,6,8,10,12,14,16-heptamethyl-17-oxoheptadeca-2,4,15-trienoyl group(1-)
3-amino-5,7-dihydroxy-6-methyl-8-[(2E,13E,15E)-5,7,9,11-tetrahydroxy-2,4,6,8,10,12,16-heptamethyl-17-oxooctadeca-2,13,15-trienoyl]-1,4,5,6-tetrahydronaphthalene-1,4-dione residue(1-)

CHEBI:71996
chebi:71996 		rifamycin-undecaketide carboxy group
(2E,4E,6S,7S,8R,9R,10R,11R,12R,13S,15E)-17-(6-amino-2,4-dihydroxy-3-methyl-5,8-dioxo-3,4,5,8-tetrahydronaphthalen-1-yl)-7,9,11,13-tetrahydroxy-2,6,8,10,12,14,16-heptamethyl-17-oxoheptadeca-2,4,15-trienoyl group