Molecule

Tulearin C; 8-O-Carbamoyl

AlkaPlorer ID: AK316916

Synonym: Tulearin A

IUPAC Name: [4,10-dihydroxy-3,6,16-trimethyl-18-(2-methylnona-1,3-dienyl)-2-oxo-1-oxacyclooctadec-13-en-9-yl] carbamate

Structure

SMILES: CCCCCC=CC(C)=CC1CC(C)CC=CCCC(O)C(OC(N)=O)CCC(C)CC(O)C(C)C(=O)O1

InChI: InChI=1S/C31H53NO6/c1-6-7-8-9-11-14-22(2)19-26-20-23(3)15-12-10-13-16-27(33)29(38-31(32)36)18-17-24(4)21-28(34)25(5)30(35)37-26/h10-12,14,19,23-29,33-34H,6-9,13,15-18,20-21H2,1-5H3,(H2,32,36)

InChIKey: IKWWLIZHWPWWDY-UHFFFAOYSA-N

Reference

Comparative Genomics and Metabolomics Analyses of Clavulanic Acid-Producing Streptomyces Species Provides Insight Into Specialized Metabolism

PubChem CID: 162930619

COCONUT: CNP0200535.3

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
None	Fascaplysinopsis	Thorectidae	Dictyoceratida	Demospongiae	Porifera	Metazoa	Eukaryota
None	Fascaplysinopsis	Thorectidae	Dictyoceratida	Demospongiae	Porifera	Metazoa	Eukaryota

Properties Information

Molecule Weight: 535.7660000000003

TPSA？: 119.08000000000004

MolLogP？: 6.375500000000009

Number of H-Donors: 3

Number of H-Acceptors: 6

RingCount: 1

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi