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erythromycin estolate

Go to external page http://purl.obolibrary.org/obo/CHEBI_4846

Term info

Label

erythromycin estolate

Synonyms
  • (3R,4S,5S,6R,7R,9R,11R,12R,13S,14R)-4-(2,6-dideoxy-3-C-methyl-3-O-methyl-alpha-L-ribo-hexopyranosyloxy)-14-ethyl-7,12,13-trihydroxy-6-[3,4,6-trideoxy-3-(dimethylamino)-2-O-propanoyl-beta-D-xylo-hexopyranosyloxy]-3,5,7,9,11,13-hexamethyloxacyclotetradecane-2,10-dione dodecyl hydrogen sulfate
  • Erythromycin estolate
database cross reference
Subsets

3_STAR

BRAND NAME
Eritroger [ ChemIDplus ]

BRAND NAME
Eriscel [ ChemIDplus ]

BRAND NAME
Estomicina [ ChemIDplus ]

BRAND NAME
Stellamicina [ ChemIDplus ]

BRAND NAME
Lauromicina [ ChemIDplus ]

BRAND NAME
Ilosone [ KEGG_DRUG ]

BRAND NAME
Eromycin [ ChemIDplus ]

IUPAC NAME
(3R,4S,5S,6R,7R,9R,11R,12R,13S,14R)-4-(2,6-dideoxy-3-C-methyl-3-O-methyl-alpha-L-ribo-hexopyranosyloxy)-14-ethyl-7,12,13-trihydroxy-6-[3,4,6-trideoxy-3-(dimethylamino)-2-O-propanoyl-beta-D-xylo-hexopyranosyloxy]-3,5,7,9,11,13-hexamethyloxacyclotetradecane-2,10-dione dodecyl hydrogen sulfate [ IUPAC ]

BRAND NAME
Roxomicina [ ChemIDplus ]

BRAND NAME
Marcoeritrex [ ChemIDplus ]

BRAND NAME
Neo-erycinum [ ChemIDplus ]

charge

0

formula

C40H71NO14.C12H26O4S

has obo namespace

chebi_ontology

has related synonym

Roxomicina, Eriscel, Marcoeritrex, Erythromycin estorate, Eromycin, lauryl sulfate propionyl erythromycin ester, Estomicina, monopropionylerythromycin laurylsulfate, erythromycin 2'-propionate dodecyl sulfate (salt), erythromycin propionate, compound with dodecyl sulfate, Eritroger, propionylerythromycin lauryl sulfate, Stellamicina, propionic acid, 2'-ester with erythromycin, dodecyl sulfate, PELS, Ilosone, Lauromicina, Neo-erycinum

id

CHEBI:4846

inchi

InChI=1S/C40H71NO14.C12H26O4S/c1-15-27-40(11,48)33(44)22(5)30(43)20(3)18-38(9,47)35(55-37-32(53-28(42)16-2)26(41(12)13)17-21(4)50-37)23(6)31(24(7)36(46)52-27)54-29-19-39(10,49-14)34(45)25(8)51-29;1-2-3-4-5-6-7-8-9-10-11-12-16-17(13,14)15/h20-27,29,31-35,37,44-45,47-48H,15-19H2,1-14H3;2-12H2,1H3,(H,13,14,15)/t20-,21-,22+,23+,24-,25+,26+,27-,29+,31+,32-,33-,34+,35-,37+,38-,39-,40-;/m1./s1

inchikey

AWMFUEJKWXESNL-JZBHMOKNSA-N

mass

1056.38852

monoisotopicmass

1055.64264

smiles

CCCCCCCCCCCCOS(O)(=O)=O.CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2OC(=O)CC)N(C)C)[C@](C)(O)C[C@@H](C)C(=O)[C@H](C)[C@@H](O)[C@]1(C)O