CHEBI:221959 - Hapalosin C

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ChEBI Name Hapalosin C
ChEBI ID CHEBI:221959
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C28H41NO6
Net Charge 0
Average Mass 487.637
Monoisotopic Mass 487.29339
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
SMILES O=C1O[C@H](C(=O)N([C@H](C(=O)CC(O[C@@H]([C@@H]1C)CCCCCCC)=O)CC2=CC=CC=C2)C)C(C)C
Metabolite of Species Details
Fischerellaspecies PCC 9431 (NCBI:txid1173023) See: PubMed
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 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