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erythronolide B

MNXM5740 is deprecated and here replaced by MNXM738371
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM738371 Image of MNXM738371
referencechebi:27977
formulaC21H38O7
global charge0
mol weight402.528
InChIKeyZFBRGCCVTUPRFQ-HWRKYNCUSA-N
InChIInChI=1S/C21H38O7/c1-8-15-11(3)17(23)12(4)16(22)10(2)9-21(7,27)19(25)13(5)18(24)14(6)20(26)28-15/h10-15,17-19,23-25,27H,8-9H2,1-7H3/t10-,11+,12+,13+,14-,15-,17+,18+,19-,21-/m1/s1
SMILESCC[C@H]1OC(=O)[C@H](C)[C@@H](O)[C@H](C)[C@@H](O)[C@](C)(O)C[C@@H](C)C(=O)[C@H](C)[C@@H](O)[C@H]1C
MNX internals
InChI (mnx)InChI=1/C21H38O7/c1-8-15-11(3)17(23)12(4)16(22)10(2)9-21(7,27)19(25)13(5)18(24)14(6)20(26)28-15/h10-15,17-19,23-25,27H,8-9H2,1-7H3/t10-,11+,12+,13+,14-,15-,17+,18+,19-,21-/m1/s1 Image of MNXM738371
SMILES (mnx)[CH3:1][CH2:8][C@@H:15]1[C@H:11]([CH3:3])[C@H:17]([OH:23])[C@@H:12]([CH3:4])[C:16](=[O:22])[C@H:10]([CH3:2])[CH2:9][C@@:21]([CH3:7])([OH:27])[C@H:19]([OH:25])[C@@H:13]([CH3:5])[C@H:18]([OH:24])[C@@H:14]([CH3:6])[C:20](=[O:26])[O:28]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)6
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:27977
chebi:27977
ZFBRGCCVTUPRFQ-HWRKYNCUSA-N 		erythronolide B
(3R,4S,5S,6R,7R,9R,11R,12S,13R,14R)-14-ethyl-4,6,7,12-tetrahydroxy-3,5,7,9,11,13-hexamethyloxacyclotetradecane-2,10-dione
12-deoxyerythronolide A
Erythronolid B
Erythronolide B

kegg.compound:C06635
keggC:C06635
ZFBRGCCVTUPRFQ-HWRKYNCUSA-N 		Erythronolide B

seed.compound:cpd04039
seedM:cpd04039
ZFBRGCCVTUPRFQ-HWRKYNCUSA-N 		Erythronolide B
erythronolide B

metacyc.compound:CPD-13947
metacycM:CPD-13947
ZFBRGCCVTUPRFQ-HWRKYNCUSA-N 		erythronolide B

chebi:23954
chebi:4847
keggC:M_C06635
seedM:M_cpd04039 		secondary/obsolete/fantasy identifier