Cas no 11011-72-6 (D-myo-Inositol,O-2-deoxy-2-(methylamino)-a-L-glucopyranosyl-(1®2)-O-5-deoxy-3-C-(hydroxymethyl)-a-L-lyxofuranosyl-(1®2)-1-[(aminoiminomethyl)amino]-1-deoxy-, 5-carbamate)

D-myo-Inositol,O-2-deoxy-2-(methylamino)-a-L-glucopyranosyl-(1®2)-O-5-deoxy-3-C-(hydroxymethyl)-a-L-lyxofuranosyl-(1®2)-1-[(aminoiminomethyl)amino]-1-deoxy-, 5-carbamate structure
11011-72-6 structure
Product Name:D-myo-Inositol,O-2-deoxy-2-(methylamino)-a-L-glucopyranosyl-(1®2)-O-5-deoxy-3-C-(hydroxymethyl)-a-L-lyxofuranosyl-(1®2)-1-[(aminoiminomethyl)amino]-1-deoxy-, 5-carbamate
CAS No:11011-72-6
MF:C21H39N5O14
MW:585.559466600418
CID:204169
PubChem ID:20055290
Update Time:2025-04-19

D-myo-Inositol,O-2-deoxy-2-(methylamino)-a-L-glucopyranosyl-(1®2)-O-5-deoxy-3-C-(hydroxymethyl)-a-L-lyxofuranosyl-(1®2)-1-[(aminoiminomethyl)amino]-1-deoxy-, 5-carbamate Chemical and Physical Properties

Names and Identifiers

    • (1S,2S,3S,4S,5R,6R)-4-({5-deoxy-2-O-[2-deoxy-2-(methylamino)-alpha-L-glucopyranosyl]-3-C-(hydroxymethyl)-alpha-L-lyxofuranosyl}oxy)-3-[(diaminomethylidene)amino]-2,5,6-trihydroxycyclohexyl carbamate
    • D-myo-Inositol,O-2-deoxy-2-(methylamino)-a-L-glucopyranosyl-(1&reg
    • 2)-1-[(aminoiminomethyl)amino]-1-deoxy-, 5-carbamate
    • 2)-O-5-deoxy-3-C-(hydroxymethyl)-a-L-lyxofuranosyl-(1&reg
    • U-12898
    • Bluensin
    • U-12898D
    • Aids010599
    • Aids-010599
    • Bluensomycin
    • Nsc111930 (sulfate salt)
    • 2-O-[5-Deoxy-3-C-(hydroxymethyl)-2-O-[2-deoxy-2-(methylamino)-α-L-glucopyranosyl]-α-L-lyxofuranosyl]-1-(amidinoamino)-1-deoxy-5-O-carbamoyl-D-scyllo-inositol
    • 2-O-[2-O-[2-(Methylamino)-2-deoxy-α-L-glucopyranosyl]-3-C-hydroxymethyl-5-deoxy-α-L-lyxofuranosyl]-1-(aminoiminomethylamino)-5-O-carbamoyl-1-deoxy-D-scyllo-inositol
    • D-Scyllo-inositol, o-2-deoxy-2-(methylamino)-.alpha.-L-glucopyranosyl-(1.fwdarw.2)-o-5-deoxy-3-C-(hydroxymethyl)-.alpha.-L-lyxofuranosyl-(1.fwdarw.2)-1-[(aminoiminomethyl)amino]-1-deoxy-, 5-carbamate
    • Bluensomicina [INN-Spanish]
    • 11011-72-6
    • NS00011554
    • Bluensomycine
    • [(1R,2S,3S,4R,5R,6R)-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] carbamate
    • Bluensomycinum [INN-Latin]
    • LWV7PWE57U
    • UNII-LWV7PWE57U
    • Antibiotic obtained from cultures of Streptomyces verticillus, or the same substance produced by any other means
    • U12898
    • GTPL10765
    • Bluensomicina
    • Bluensomycinum
    • C17573
    • U 12898
    • CHEMBL2104642
    • Q27155138
    • U 12898D
    • D-scyllo-Inositol, O-2-deoxy-2-(methylamino)-alpha-L-glucopyranosyl-(1=>2)-O-5-deoxy-3-C-(hydroxymethyl)-alpha-L-lyxofuranosyl-(1=>2)-1-((aminoiminomethyl)amino)-1-deoxy-, 5-carbamate
    • CHEBI:81193
    • SCHEMBL691672
    • Bluensomycine [INN-French]
    • Bluensomycin [INN]
    • DTXSID10891345
    • [(1S,2S,3S,4S,5R,6R)-4-[(2R,3R,4R,5S)-3-[(2S,3S,4S,5R,6S)-4,5-dihydroxy-6-(hydroxymethyl)-3-(methylamino)tetrahydropyran-2-yl]oxy-4-hydroxy-4-(hydroxymethyl)-5-methyl-tetrahydrofuran-2-yl]oxy-3-guanidino-2,5,6-trihydroxy-cyclohexyl] carbamate
    • [(1S,2S,3S,4S,5R,6R)-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] carbamate
    • 2-O-(5-Deoxy-3-C-(hydroxymethyl)-2-O-(2-deoxy-2-(methylamino)-alpha-L-glucopyranosyl)-alpha-L-lyxofuranosyl)-1-(amidinoamino)-1-deoxy-5-O-carbamoyl-D-scyllo-inositol
    • 2-O-[5-Deoxy-3-C-(hydroxymethyl)-2-O-[2-deoxy-2-(methylamino)-alpha-L-glucopyranosyl]-alpha-L-lyxofuranosyl]-1-(amidinoamino)-1-deoxy-5-O-carbamoyl-D-scyllo-inositol
    • ((1R,2S,3S,4R,5R,6R)-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) carbamate
    • Bluensomycine (INN-French)
    • DTXCID501030500
    • Glebomycin
    • Bluensomicina (INN-Spanish)
    • ((1S,2S,3S,4S,5R,6R)-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) carbamate
    • Bluensomycinum (INN-Latin)
    • D-myo-Inositol,O-2-deoxy-2-(methylamino)-a-L-glucopyranosyl-(1®2)-O-5-deoxy-3-C-(hydroxymethyl)-a-L-lyxofuranosyl-(1®2)-1-[(aminoiminomethyl)amino]-1-deoxy-, 5-carbamate
    • Inchi: 1S/C21H39N5O14/c1-5-21(35,4-28)16(40-17-8(25-2)10(30)9(29)6(3-27)37-17)18(36-5)38-14-7(26-19(22)23)11(31)15(39-20(24)34)13(33)12(14)32/h5-18,25,27-33,35H,3-4H2,1-2H3,(H2,24,34)(H4,22,23,26)/t5-,6-,7-,8-,9-,10-,11-,12+,13+,14+,15+,16-,17-,18-,21+/m0/s1
    • InChI Key: RQLDKUSQKQMFCN-AEXVNIBOSA-N
    • SMILES: O([C@H]1[C@@H]([C@H]([C@@H]([C@H]([C@@H]1/N=C(\N)/N)O)OC(N)=O)O)O)[C@H]1[C@@H]([C@@](CO)([C@H](C)O1)O)O[C@H]1[C@H]([C@@H]([C@H]([C@H](CO)O1)O)O)NC

Computed Properties

  • Exact Mass: 585.24935093g/mol
  • Monoisotopic Mass: 585.24935093g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 12
  • Hydrogen Bond Acceptor Count: 16
  • Heavy Atom Count: 40
  • Rotatable Bond Count: 10
  • Complexity: 900
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 15
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -7.3
  • Topological Polar Surface Area: 328?2

D-myo-Inositol,O-2-deoxy-2-(methylamino)-a-L-glucopyranosyl-(1®2)-O-5-deoxy-3-C-(hydroxymethyl)-a-L-lyxofuranosyl-(1®2)-1-[(aminoiminomethyl)amino]-1-deoxy-, 5-carbamate Related Literature

Recommended suppliers
Shanghai Bent Chemical Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Handan Zechi Trading Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
SHOCHEM(SHANGHAI) CO.,lTD
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
SHOCHEM(SHANGHAI) CO.,lTD
Nantong Boya Environmental Protection Technology Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Nantong Boya Environmental Protection Technology Co., Ltd
Wuhan ChemNorm Biotech Co.,Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Wuhan ChemNorm Biotech Co.,Ltd.