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3-O-alpha-L-mycarosylerythronolide B

Properties

Image

Occurences in reactions

MNX_ID

MNXM734583

	#reac
in my sandbox	0
in MNXref (generic)	3
in models (compartimentalized)	0

formula

C₂₈H₅₀O₁₀

charge

mass

546.3404

reference

chebi:28343

InChIKey

WWWXDCNRNMZGEN-UPOWUTDQSA-N

InChI

InChI=1S/C28H50O10/c1-10-19-14(3)22(30)15(4)21(29)13(2)11-27(8,34)24(31)16(5)23(17(6)26(33)37-19)38-20-12-28(9,35)25(32)18(7)36-20/h13-20,22-25,30-32,34-35H,10-12H2,1-9H3/t13-,14+,15+,16+,17-,18+,19-,20+,22+,23+,24-,25+,27-,28-/m1/s1

SMILES

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

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:28343 chebi:28343	3-O-alpha-L-mycarosylerythronolide B (3R,4S,5R,6R,7R,9R,11R,12S,13R,14R)-4-(2,6-dideoxy-3-C-methyl-alpha-L-ribo-hexopyranosyloxy)-14-ethyl-6,7,12-trihydroxy-3,5,7,9,11,13-hexamethyloxacyclotetradecane-2,10-dione 3-O-Mycarosylerythronolide B 3-O-alpha-mycarosylerythronolide B 4-(4,5-dihydroxy-4,6-dimethyl-tetrahydro-pyran-2-yloxy)-14-ethyl-6,7,12-trihydroxy-3,5,7,9,11,13-hexamethyl-oxacyclotetradecane-2,10-dione Antibiotic A-31438
seed.compound:cpd04034 seedM:cpd04034	3-O-Mycarosylerythronolide B 3-O-alpha-Mycarosylerythronolide B 3-alpha-L-Mycarosylerythronolide B 3-alpha-mycarosylerythronolide B 4-(4,5-Dihydroxy-4,6-dimethyl-tetrahydro-pyran-2-yloxy)-14-ethyl-6,7,12-trihydroxy-3,5,7,9,11,13-hexamethyl-oxacyclotetradecane-2,10-dione alpha-L-mycarosyl erythronolide B
kegg.compound:C06630 keggC:C06630	3-O-alpha-Mycarosylerythronolide B 3-alpha-L-Mycarosylerythronolide B 4-(4,5-Dihydroxy-4,6-dimethyl-tetrahydro-pyran-2-yloxy)-14-ethyl-6,7,12-trihydroxy-3,5,7,9,11,13-hexamethyl-oxacyclotetradecane-2,10-dione
metacyc.compound:CPD-13837 metacycM:CPD-13837	3-alpha-mycarosylerythronolide B alpha-L-mycarosyl erythronolide B
chebi:1616 chebi:19951 keggC:M_C06630 seedM:M_cpd04034	secondary/obsolete/fantasy identifier