Hapalosin C (CHEBI:221959)

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CHEBI:221959 - Hapalosin C

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ChEBI ID	CHEBI:221959
ChEBI Name	Hapalosin C
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C28H41NO6
Net Charge	0
Average Mass	487.637
Monoisotopic Mass	487.29339
SMILES	CCCCCCC[C@H]1OC(=O)CC(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@H](C(C)C)OC(=O)[C@H]1C
InChI	InChI=1S/C28H41NO6/c1-6-7-8-9-13-16-24-20(4)28(33)35-26(19(2)3)27(32)29(5)22(23(30)18-25(31)34-24)17-21-14-11-10-12-15-21/h10-12,14-15,19-20,22,24,26H,6-9,13,16-18H2,1-5H3/t20-,22-,24+,26-/m0/s1
InChIKey	OOKZFSOXPOOYFR-XDDOSOJWSA-N

Species of Metabolite	Component	Source	Comments
Fischerellaspecies PCC 9431 (ncbitaxon:1173023)	-	PubMed (33599093)

Roles Classification

Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid).

ChEBI Ontology

Outgoing Relation(s)
	Hapalosin C (CHEBI:221959) is a cyclodepsipeptide (CHEBI:35213)

IUPAC Name
(2S,5S,10R,11S)-5-benzyl-10-heptyl-4,11-dimethyl-2-propan-2-yl-1,9-dioxa-4-azacyclododecane-3,6,8,12-tetrone