Saturnispol B (CHEBI:213802)

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CHEBI:213802 - Saturnispol B

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ChEBI ID	CHEBI:213802
ChEBI Name	Saturnispol B
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C28H34O9
Net Charge	0
Average Mass	514.571
Monoisotopic Mass	514.22028
SMILES	C/C=C/C=C/C(O)=C1C[C@](C)(O)[C@]2(O)O[C@]3(C)C(=O)C(C)=C(O)C(=C(O)/C=C/C=C/CO)[C@@H]3[C@]2(C)C1=O
InChI	InChI=1S/C28H34O9/c1-6-7-9-12-18(30)17-15-25(3,35)28(36)26(4,24(17)34)22-20(19(31)13-10-8-11-14-29)21(32)16(2)23(33)27(22,5)37-28/h6-13,22,29-32,35-36H,14-15H2,1-5H3/b7-6+,11-8+,12-9+,13-10+,18-17?,20-19?/t22-,25+,26-,27+,28+/m1/s1
InChIKey	ZQLXNVBKDCXOIW-GQZMFSPWSA-N

Species of Metabolite	Component	Source	Comments
Trichoderma saturnisporum (ncbitaxon:5549)	-	PubMed (29973484)

ChEBI Ontology

Outgoing Relation(s)
	Saturnispol B (CHEBI:213802) is a aliphatic alcohol (CHEBI:2571)

IUPAC Name
(4S,4aR,5aS,9aR,9bR)-9-[(2E,4E)-1,6-dihydroxyhexa-2,4-dienylidene]-4,4a,8-trihydroxy-2-[(2E,4E)-1-hydroxyhexa-2,4-dienylidene]-4,5a,7,9b-tetramethyl-3,9a-dihydrodibenzouran-1,6-dione

Manual Xrefs	Databases
78439265	ChemSpider