Cinodine
Molecular Formula:
C37H60ClN13O13
InChI: InChI=1/C37H59N13O13.ClH/c1-17-23(29(53)27(45-33(39)40)32(60-17)61-19-8-5-18(6-9-19)7-10-22(51)44-14-4-13-43-12-3-2-11-38)48-36(56)50-30-26(47-35(42)55)28(52)21(16-58-30)62-31-25(46-34(41)54)24-20(15-59-31)63-37(57)49-24;/h5-10,17,20-21,23-32,43,52-53H,2-4,11-16,38H2,1H3,(H,44,51)(H,49,57)(H4,39,40,45)(H3,41,46,54)(H3,42,47,55)(H2,48,50,56);1H/b10-7+;/t17-,20-,21-,23-,24+,25-,26-,27-,28+,29+,30+,31+,32-;/m1./s1/f/h44,46-50H,39-42H2;
InChIKey: InChIKey=ZSPJOQBEUKQIIA-XFTNJBGRDZ
SMILES: CC1C(C(C(C(O1)OC2=CC=C(C=C2)C=CC(=O)NCCCNCCCCN)N=C(N)N)O)NC(=O)NC3C(C(C(CO3)OC4C(C5C(CO4)OC(=O)N5)NC(=O)N)O)NC(=O)N.Cl
Names:
Antibiotic BM 123gamma
Antibiotic BM 123 gamma
Antibiotic LL-BM 123 gamma
BM 123 gamma
Cinodine Hydrochloride (Mixture with casregno 68782-58-1, same MW same fmla_structure)
Cinodine
LL-BM 123 gamma
(E)-N-[3-(4-aminobutylamino)propyl]-3-[4-[(2R,3R,4S,5S,6R)-5-[[(2S,3R,4R,5R)-3-(carbamoylamino)-5-[[(1R,2R,3S,6R)-2-(carbamoylamino)-8-oxo-4,7-dioxa-9-azabicyclo[4.3.0]non-3-yl]oxy]-4-hydroxy-oxan-2-yl]carbamoylamino]-3-(diaminomethylideneamino)-4-hydroxy-6-methyl-oxan-2-yl]oxyphenyl]prop-2-enamide hydrochloride
52932-64-6
Registries:
PubChem CID 6436146
PubChem ID 214000
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