Butyrolactol B (CHEBI:205354)

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CHEBI:205354 - Butyrolactol B

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ChEBI ID	CHEBI:205354
ChEBI Name	Butyrolactol B
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C27H44O9
Net Charge	0
Average Mass	512.640
Monoisotopic Mass	512.29853
SMILES	CC(C)CC/C=C/C=C\CC/C=C/C=C/CC(C)C(O)C(O)C(O)C(O)C(O)C1OC(=O)C(O)C1O
InChI	InChI=1S/C27H44O9/c1-17(2)15-13-11-9-7-5-4-6-8-10-12-14-16-18(3)19(28)20(29)21(30)22(31)23(32)26-24(33)25(34)27(35)36-26/h5,7-12,14,17-26,28-34H,4,6,13,15-16H2,1-3H3/b7-5-,10-8+,11-9+,14-12+
InChIKey	QOXADYBJIYSAHC-RVPOWQAWSA-N

Species of Metabolite	Component	Source	Comments
Streptomyces (ncbitaxon:1883)	-	PubMed (1429230)

ChEBI Ontology

Outgoing Relation(s)
	Butyrolactol B (CHEBI:205354) is a aliphatic alcohol (CHEBI:2571)

IUPAC Name
3,4-dihydroxy-5-[(8E,10E,14Z,16E)-1,2,3,4,5-pentahydroxy-6,20-dimethylhenicosa-8,10,14,16-tetraenyl]oxolan-2-one

Manual Xrefs	Databases
8431335	ChemSpider