CHEBI:200297 - Saccharolidin A

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Saccharolidin A
ChEBI ID CHEBI:200297
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C38H60O9
Net Charge 0
Average Mass 660.889
Monoisotopic Mass 660.42373
InChI InChI=1S/C38H60O9/c1-10-11-12-15-32-30-21-24(2)14-13-16-33(44-9)36(28(6)35(42)27(5)31(40)19-18-26(4)29(7)39)47-34(41)20-17-25(3)22-38(8,37(30)43)46-23-45-32/h13-14,16-20,22,26-30,32-33,35-37,39,42-43H,10-12,15,21,23H2,1-9H3/b16-13-,19-18+,20-17-,24-14-,25-22-
InChIKey MXONVNSWVIIQFN-SQPXZVOOSA-N
SMILES O=C1OC(C(OC)C=CC=C(CC2C(C(C=C(C=C1)C)(OCOC2CCCCC)C)O)C)C(C(O)C(C(=O)/C=C/C(C(O)C)C)C)C
Metabolite of Species Details
Lentzea aerocolonigenes (NCBI:txid68170) See: DOI
ChEBI Ontology
Outgoing Saccharolidin A (CHEBI:200297) is a macrolide (CHEBI:25106)
IUPAC Name
(2Z,4Z,10Z,12Z)-8-[(E)-3,9-dihydroxy-4,8-dimethyl-5-oxodec-6-en-2-yl]-20-hydroxy-9-methoxy-1,3,13-trimethyl-16-pentyl-7,17,19-trioxabicyclo[13.4.1]icosa-2,4,10,12-tetraen-6-one
Manual Xref Database
78444545 ChemSpider
View more database links