erythromycin estolate

CHEBI:4846 ·resolve ·ANTIMICROBIAL_UNSPECIFIED ·EXACT SEEDED

Machine-generated and unreviewed. Identity, structure and cross-references come straight from ChEBI's and CARD's own data; no curator has signed off on this record yet.

Classification

Strictly broader compounds or drug classes this molecule belongs to.

CHEBI:38012 CHEBI:38012
CHEBI:48924 CHEBI:48924

Chemical structure

Computed structure properties
Molecular formula	C12H26O4S.C40H71NO14
Charge	0
Average mass	1056.404 Da
Monoisotopic mass	1055.64264 Da
Source	ChEBI
InChIKey	AWMFUEJKWXESNL-JZBHMOKNSA-N

SMILES

CCC(=O)O[C@H]1[C@H](O[C@@H]2[C@@H](C)[C@H](O[C@H]3C[C@@](C)(OC)[C@@H](O)[C@H](C)O3)[C@@H](C)C(=O)O[C@H](CC)[C@@](C)(O)[C@H](O)[C@@H](C)C(=O)[C@H](C)C[C@@]2(C)O)O[C@H](C)C[C@@H]1N(C)C.CCCCCCCCCCCCOS(=O)(=O)O

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

Also called

Eriscel (BRAND_NAME)— chebi
Eritroger (BRAND_NAME)— chebi
Eromycin (BRAND_NAME)— chebi
Estomicina (BRAND_NAME)— chebi
Ilosone (BRAND_NAME)— chebi
Lauromicina (BRAND_NAME)— chebi
Marcoeritrex (BRAND_NAME)— chebi
Neo-erycinum (BRAND_NAME)— chebi
Roxomicina (BRAND_NAME)— chebi
Stellamicina (BRAND_NAME)— chebi
(3R,4S,5S,6R,7R,9R,11R,12R,13S,14R)-4-(2,6-dideoxy-3-C-methyl-3-O-methyl-α-L-ribo-hexopyranosyloxy)-14-ethyl-7,12,13-trihydroxy-6-[3,4,6-trideoxy-3-(dimethylamino)-2-O-propanoyl-β-D-xylo-hexopyranosyloxy]-3,5,7,9,11,13-hexamethyloxacyclotetradecane-2,10-dione dodecyl hydrogen sulfate (EXACT_SYNONYM)— chebi
Erythromycin estolate (EXACT_SYNONYM)— chebi
Erythromycin estorate (EXACT_SYNONYM)— chebi
PELS (EXACT_SYNONYM)— chebi
erythromycin 2'-propionate dodecyl sulfate (salt) (EXACT_SYNONYM)— chebi
erythromycin propionate, compound with dodecyl sulfate (EXACT_SYNONYM)— chebi
lauryl sulfate propionyl erythromycin ester (EXACT_SYNONYM)— chebi
monopropionylerythromycin laurylsulfate (EXACT_SYNONYM)— chebi
propionic acid, 2'-ester with erythromycin, dodecyl sulfate (EXACT_SYNONYM)— chebi
propionylerythromycin lauryl sulfate (EXACT_SYNONYM)— chebi

Cross-references

Equivalent identifiers for this same structure in other resources.

beilstein:3897327
cas:3521-62-8
kegg.compound:C08031
kegg.drug:D00851
lipidmaps:LMPK04000015
patent:US3000874

Activity roles

Every antimicrobial role a source asserts for this compound — the unreduced evidence behind its antimicrobial_class.

CHEBI:33281 CHEBI:33281

Source concepts

Every upstream concept that resolved to this record. The merge is the product: this is what shows ChEBI and CARD are describing the same structure.

Upstream concepts merged into this record
Source	Native ID	Label	Minted CURIE	Version
CHEBI	`CHEBI:4846`	erythromycin estolate	`antibioticmech:chebi-96d90096b1`	2026-08-30

Mechanism summary

Clinical status: APPROVED

Curation history

SEEDED_FROM_SOURCES 2026-08-30 · seed_from_sources
Seeded from data/raw/ inventories (CHEBI)
RESEEDED_FROM_SOURCES 2026-08-30 · seed_from_sources
Re-seeded from updated data/raw/ inventories
RESEEDED_FROM_SOURCES 2026-08-30 · seed_from_sources
Re-seeded from updated data/raw/ inventories
RESEEDED_FROM_SOURCES 2026-08-31 · seed_from_sources
Re-seeded from updated data/raw/ inventories
RESEEDED_FROM_SOURCES 2026-08-31 · seed_from_sources
Re-seeded from updated data/raw/ inventories

Provenance

Seeded by scripts/seed_from_sources.py from the committed inventories in data/raw/. View the record.