Preferred Name

streptomycin sulfate
Synonyms

Streptomycin sulfate

ID

http://purl.obolibrary.org/obo/CHEBI_32158

charge

0

database_cross_reference

KEGG:D01350

CAS:3810-74-0

BPDB:2472

formula

C42H84N14O36S3

2C21H39N7O12.3H2O4S

has_exact_synonym

Streptomycin sulfate

has_functional_parent

http://purl.obolibrary.org/obo/CHEBI_17076

has_obo_namespace

chebi_ontology

id

CHEBI:32158

in_subset

http://purl.obolibrary.org/obo/chebi#2_STAR

inchi

InChI=1S/2C21H39N7O12.3H2O4S/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*4-18,26,29,31-36H,3H2,1-2H3,(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

inchikey

QTENRWWVYAAPBI-YCRXJPFRSA-N

label

streptomycin sulfate

mass

1457.389

monoisotopicmass

1456.43348

notation

CHEBI:32158

prefLabel

streptomycin sulfate

smiles

OS(=O)(O)=O.[C@@H]1([C@H](O[C@@H]2[C@H]([C@@H]([C@@H](NC(=N)N)[C@@H]([C@H]2O)O)O)NC(N)=N)O[C@H]([C@@]1(C=O)O)C)O[C@H]3[C@H]([C@@H]([C@@H](O)[C@@H](O3)CO)O)NC.OS(=O)(O)=O.OS(=O)(O)=O.[C@@H]1([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]([C@@]1(C=O)O)C)O[C@H]3[C@H]([C@@H]([C@H]([C@@H](O3)CO)O)O)NC

subClassOf

http://purl.obolibrary.org/obo/CHEBI_38012

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