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CHEBI:221790 - Shuangdaolide B

ChEBI IDCHEBI:221790
ChEBI NameShuangdaolide B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC33H46O8
Net Charge0
Average Mass570.723
Monoisotopic Mass570.31927
SMILESCC1=C(O)C(=O)[C@@H]2C=C[C@H](O)C[C@@H]([C@H](C)[C@@H]3O[C@]4(CCCO4)CC[C@H]3C)OC(=O)C/C=C(\C)[C@H](O)/C=C(C)/C=C/[C@@H]12
InChIInChI=1S/C33H46O8/c1-19-7-10-25-22(4)30(37)31(38)26(25)11-9-24(34)18-28(40-29(36)12-8-20(2)27(35)17-19)23(5)32-21(3)13-15-33(41-32)14-6-16-39-33/h7-11,17,21,23-28,32,34-35,37H,6,12-16,18H2,1-5H3/b10-7+,11-9?,19-17+,20-8+/t21-,23+,24+,25+,26-,27-,28+,32-,33-/m1/s1
InChIKeyYRCPAEJYEVLNJS-RCHXMUGHSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (34388000)
ChEBI Ontology
Outgoing Relation(s)
Shuangdaolide B (CHEBI:221790) is a macrolide (CHEBI:25106)