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Isepamicin (USAN/INN)

Properties

Image

Occurences in reactions

MNX_ID

MNXM738413

	#reac
in my sandbox	0
in MNXref (generic)	2
in models (compartimentalized)	0

formula

C₂₂H₄₃N₅O₁₂

charge

mass

569.29082

reference

keggD:D02545

InChIKey

UDIIBEDMEYAVNG-ZKFPOVNWSA-N

InChI

InChI=1S/C22H43N5O12/c1-22(35)6-36-20(15(33)18(22)26-2)39-17-8(27-19(34)9(28)4-23)3-7(25)16(14(17)32)38-21-13(31)12(30)11(29)10(5-24)37-21/h7-18,20-21,26,28-33,35H,3-6,23-25H2,1-2H3,(H,27,34)/t7-,8+,9-,10+,11+,12-,13+,14-,15+,16+,17-,18+,20+,21+,22-/m0/s1

SMILES

CN[C@@H]1[C@@H](O)[C@@H](O[C@@H]2[C@@H](O)[C@H](O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](N)C[C@H]2NC(=O)[C@@H](O)CN)OC[C@]1(C)O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
kegg.drug:D02545 keggD:D02545	Isepamicin (USAN/INN)
sabiork.compound:26284 sabiorkM:26284	Isepamicin
hmdb:HMDB0041911	Isepamicin (2S)-3-amino-N-[(1R,2S,3S,4R,5S)-5-amino-4-{[(2R,3R,4S,5S,6R)-6-(aminomethyl)-3,4,5-trihydroxyoxan-2-yl]oxy}-2-{[(2R,3R,4R,5R)-3,5-dihydroxy-5-methyl-4-(methylamino)oxan-2-yl]oxy}-3-hydroxycyclohexyl]-2-hydroxypropanimidic acid HAPA-b ISP Isépalline Isepacin Isepamicin disulfate Isepamicin monosulfate Isepamicin sulfate Isepamicin sulphate N-(S-3-Amino-2-hydroxypropionyl)gentamicin Schering-plough brand OF isepamicin sulfate isepamicin
hmdb:HMDB41911 keggD:M_D02545	secondary/obsolete/fantasy identifier