Bluensomycin
CAS Registry Number®
11011-72-6
CAS Name
BluensomycinMolecular Formula
C21H39N5O14Molecular Mass
585.56Cite this Page
Bluensomycin. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=11011-72-6 (retrieved ) (CAS RN: 11011-72-6). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
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
InChIKey
InChIKey=RQLDKUSQKQMFCN-DOOXDOMHSA-N
SMILES
O([C@H]1[C@H](O[C@H]2[C@@H](NC(=N)N)[C@H](O)[C@H](OC(N)=O)[C@H](O)[C@H]2O)O[C@@H](C)[C@@]1(CO)O)[C@H]3[C@@H](NC)[C@H](O)[C@@H](O)[C@H](CO)O3
Canonical SMILES
O=C(OC1C(O)C(O)C(OC2OC(C)C(O)(CO)C2OC3OC(CO)C(O)C(O)C3NC)C(NC(=N)N)C1O)N
Other Names for this Substance
- D-myo-Inositol, O-2-deoxy-2-(methylamino)-α-L-glucopyranosyl-(1→2)-O-5-deoxy-3-C-(hydroxymethyl)-α-L-lyxofuranosyl-(1→2)-1-[(aminoiminomethyl)amino]-1-deoxy-, 5-carbamate
- Bluensomycin
- U 12898D
- Bluensin
- U 12898
Deleted or Replaced CAS Registry Numbers
521060-91-3