AG00DE72

5490-27-7 | Dihydrostreptomycin (sulfate)

AG00DE72

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CAS Number	5490-27-7
Catalog Number	AG00DE72(AGN-PC-0SIAJM)
Chemical Name	Dihydrostreptomycin (sulfate)
EC Number	226-823-7
IUPAC Name	2-[(1R,2R,3S,4R,5R,6S)-3-(diaminomethylideneamino)-4-[(2R,3R,4R,5S)-3-[(2S,3S,4S,5R,6S)-4,5-dihydroxy-6-(hydroxymethyl)-3-(methylamino)oxan-2-yl]oxy-4-hydroxy-4-(hydroxymethyl)-5-methyloxolan-2-yl]oxy-2,5,6-trihydroxycyclohexyl]guanidine;sulfuric acid
InChI	InChI=1S/2C21H41N7O12.3H2O4S/c2*1-5-21(36,4-30)16(40-17-9(26-2)13(34)10(31)6(3-29)38-17)18(37-5)39-15-8(28-20(24)25)11(32)7(27-19(22)23)12(33)14(15)35;3*1-5(2,3)4/h2*5-18,26,29-36H,3-4H2,1-2H3,(H4,22,23,27)(H4,24,25,28);3*(H2,1,2,3,4)/t2*5-,6-,7+,8-,9-,10-,11+,12-,13-,14+,15+,16-,17-,18-,21+;;;/m00.../s1
InChI Key	CZWJCQXZZJHHRH-YCRXJPFRSA-N
MDL Number	MFCD31747061
Molecular Formula	C42H88N14O36S3
Molecular Weight	1461.4153
SMILES	O[C@]1([C@H]([C@H](O[C@@H]2[C@H]([C@@H]([C@H]([C@@H]([C@H]2O)O)NC(N)=N)O)NC(N)=N)O[C@H]1C)O[C@H]3[C@H]([C@@H]([C@H]([C@@H](O3)CO)O)O)NC)CO.O[C@]4([C@H]([C@H](O[C@@H]5[C@H]([C@@H]([C@H]([C@@H]([C@H]5O)O)NC(N)=N)O)NC(N)=N)O[C@H]4C)O[C@H]6[C@H]([C@@H]([C@H]([C@@H](O6)CO)O)O)NC)CO.O=S(O)(O)=O.O=S(O)(O)=O.O=S(O)(O)=O
UNII	T7D4876IUE
Synonyms	Citrocil, Dihydrostreptomycin, Dihydrostreptomycin Sulfate, Sulfate, Dihydrostreptomycin, Panstreptin, Dihydrostreptomycin sulfate, Didromycin, 5490-27-7, UNII-T7D4876IUE, Didromycine, Abiocine, DIHYDROSTREPTOMYCIN SESQUISULFATE, Dihydrostreptomycin 3/2 sulfate, Dihydrostreptomycin Sulfate [USP], EINECS 226-823-7, AI3-50133, T7D4876IUE, Dihydrostreptomycin sequisulphate, Dihydrostreptomycin sulfate (2:3)(salt), Dihydrostreptomycin sulfate (USP), D-Streptamine, O-2-deoxy-2-(methylamino)-alpha-L-glucopyranosyl-(1-2)-O-5-deoxy-3-C-(hydroxymethyl)-alpha-L-lyxofuranosyl-(1-4)-N,N'-bis(aminoiminomethyl)-, sulfate (2:3) (salt), Dihydrostreptomyzinsulfat, Dihydrostreptomycinium sulfuricum, 2C21H41N7O12.3H2O4S, AC1L2ISM, 2-[(1R,2R,3S,4R,5R,6S)-3-(diaminomethylideneamino)-4-[(2R,3R,4R,5S)-3-[(2S,3S,4S,5R,6S)-4,5-dihydroxy-6-(hydroxymethyl)-3-(methylamino)oxan-2-yl]oxy-4-hydroxy-4-(hydroxymethyl)-5-methyloxolan-2-yl]oxy-2,5,6-trihydroxycyclohexyl]guanidine; sulfuric acid, dihydrostreptomycin-sulfate, NCGC00094655-01, CAS-5490-27-7, Streptomycin, dihydro-, sulfate (2:3) (salt), DSSTox_CID_25824, DSSTox_RID_81155, DSSTox_GSID_45824, CHEMBL3188576, DTXSID6045824, Tox21_111309, AKOS026750384, hydroxycyclohexyl]guanidine;sulfuric acid, D-Streptamine, O-2-deoxy-2-(methylamino)-alpha-L-glucopyranosyl-(1-2)-O-5-deoxy- 3-C-(hydroxymethyl)-alpha-L-lyxofuranosyl-(1-4)-N,N'-bis(aminoiminomethyl)-, sulfate (2:3) (salt), LS-146993, D02512, W-105598, Dihydrostreptomycin sulfate, Antibiotic for Culture Media Use Only, 1-[(1R,2R,3S,4R,5R,6S)-3-carbamimidamido-4-[(2R,3R,4R,5S)-3-[(2S,3S,4S,5R,6S)-4,5-dihydroxy-6-(hydroxymethyl)-3-(methylamino)oxan-2-yl]oxy-4-hydroxy-4-(hydroxymethyl)-5-methyloxolan-2-yl]oxy-2,5,6-tri, D-Streptamine, O-2-deoxy-2-(methylamino)-alpha-L-glucopyranosyl-(1->2)-O-5-deoxy-3-C-(hydroxymethyl)-alpha-L-lyxofuranosyl-(1->4)-N1,N3-bis(aminoiminomethyl)-, sulfate (2:3), D-Streptamine, O-2-deoxy-2-(methylamino)-alpha-L-glucopyranosyl-(1.fwdarw.2)-O-5-deoxy-3-C-(hydroxymethyl)-alpha-L-lyxofuranosyl-(1.fwdarw.4)-N,N'-bis(aminoiminomethyl)-, sulfate (2:3) (salt), Citrocil, dihydrostreptomycin, Mixture Name, Diathal (Veterinary), Azimycin (Veterinary), Dihydrostreptomycin sulphate, Sulfate, Dihydrostreptomycin, Dihydrostreptomycin (sulfate), Dihydrostreptomycin sulfate(2:3), CID21653, MFCD00070252, C21H41N7O12.3/2H2O4S, Dihydrostreptomycin sesquisulfate, 98% - 1G 1g, C21-H41-N7-O12.3/2H2-O4-S, D004096, D-Streptamine, O-2-deoxy-2-(methylamino)-.alpha.-L-glucopyranosyl-(1.fwdarw.2)-O-5-deoxy-3-C-(hydroxymethyl)-.alpha.-L-lyxofuranosyl-(1.fwdarw.4)-N,N'-bis(aminoiminomethyl)-, sulfate (2:3) (salt), D-estreptamina, o-2-deoxi-2-(metilamino)-?-l-glucopiranosil-(1?2)-o-5-deoxi-3-c-(hidroximetil)-?-l-lixofuranosil-(1?4)-n1,n3-bis(aminoiminometil)-, sulfato (2:3), D-Streptamine, O-2-deoxy-2-(methylamino)-.alpha.-L-glucopyranosyl-(1.fwdarw.2)-O-5-deoxy-3-C-(hydroxymethyl)-.alpha.-L-lyxofuranosyl-(1.fwdarw.4)-N1,N3-bis(aminoiminomethyl)-, sulfate (2:3), D-Streptamine, O-2-deoxy-2-(methylamino)-.alpha.-L-glucopyranosyl-(1?2)-O-5-deoxy-3-C-(hydroxymethyl)-.alpha.-L-lyxofuranosyl-(1?4)-N,N'-bis(aminoiminomethyl)-, sulfate (2:3) (salt),

Complexity	993
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	5
Defined Atom Stereocenter Count	30
Defined Bond Stereocenter Count	0
Exact Mass	1460.465g/mol
Formal Charge	0
Heavy Atom Count	95
Hydrogen Bond Acceptor Count	42
Hydrogen Bond Donor Count	32
Isotope Atom Count	0
Molecular Weight	1461.408g/mol
Monoisotopic Mass	1460.465g/mol
Rotatable Bond Count	18
Topological Polar Surface Area	928A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H302-H312-H332-H360
Packing Group	Ⅲ
Precautionary statements	P201-P280-P308+P313
UN Code	UN 2811

Certificate of Analysis

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