The Biofilms Structural Database |
STREPTOMYCIN |
|
---|---|
4EJW |
|
Code
SRY | |
Name |
STREPTOMYCIN |
Molecular Weight |
581.57 |
Isomeric SMILES |
CN[C@H]1[C@H](O)[C@@H](O)[C@H](CO)O[C@H]1O[C@H]1[C@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](NC(N)=N)[C@@H](O)[C@@H]2NC(N)=N)O[C@@H](C)[C@]1(O)C=O |
Formula |
C21H39N7O12 |
Identifiers |
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-methanoyl-5-methyl-oxolan-2-yl]oxy-2,5,6-trihydroxy-cyclohexyl]guanidine |
Formal Charge |
0 |
InChI |
InChI=1S/C21H39N7O12/c1-5-21(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/h4-18,26,29,31-36H,3H2,1-2H3,(H4,22,23,27)(H4,24,25,28)/t5-,6-,7+,8-,9-,10-,11+,12-,13-,14+,15+,16-,17-,18-,21+/m0/s1 |
Atom Count |
79 |
InChIKey |
UCSJYZPVAKXKNQ-HZYVHMACSA-N |
PDB codes |
4EJW |
Type |
NON-POLYMER |
Chiral Atom Count |
15 |
Chiral Atoms |
C11, C12, C13, C21, C22, C23, C31, C32, C33, C41, C42, C43, C51, C53, C61 |
Bond Count |
81 |
Aromatic Bond Count |
0 |
Leaving Atoms |
n/a |