EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:221799 - Shuangdaolide D

ChEBI IDCHEBI:221799
ChEBI NameShuangdaolide D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC33H46O8
Net Charge0
Average Mass570.723
Monoisotopic Mass570.31927
SMILESC/C=C/C(=O)CC[C@@H](C)[C@H]1OC(=O)C/C=C(\C)[C@H](O)/C=C(\C)C=C[C@H]2C(C)=C(O)C(=O)[C@@H]2/C=C\[C@H](O)C[C@H](O)[C@@H]1C
InChIInChI=1S/C33H46O8/c1-7-8-24(34)12-10-21(4)33-23(6)29(37)18-25(35)13-15-27-26(22(5)31(39)32(27)40)14-9-19(2)17-28(36)20(3)11-16-30(38)41-33/h7-9,11,13-15,17,21,23,25-29,33,35-37,39H,10,12,16,18H2,1-6H3/b8-7+,14-9?,15-13-,19-17+,20-11+/t21-,23+,25+,26+,27-,28-,29+,33-/m1/s1
InChIKeyAWWKIFFQGNPUFN-MICTUHIMSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (34388000)
ChEBI Ontology
Outgoing Relation(s)
Shuangdaolide D (CHEBI:221799) is a macrolide (CHEBI:25106)