Molecule

Ovigerine; (S)-form

AlkaPlorer ID: AK308806

Synonym: None

IUPAC Name: 4,6,19,21-tetraoxa-13-azahexacyclo[10.10.1.02,10.03,7.016,23.018,22]tricosa-1(23),2(10),3(7),8,16,18(22)-hexaene

SMILES: C1=C2CC3NCCC4=C3C(=C3OCOC3=C4)C2=C2OCOC2=C1

InChI: InChI=1S/C18H15NO4/c1-2-12-17(22-7-20-12)15-9(1)5-11-14-10(3-4-19-11)6-13-18(16(14)15)23-8-21-13/h1-2,6,11,19H,3-5,7-8H2

InChIKey: UXVJNYDGHSTBCL-UHFFFAOYSA-N

PubChem CID: 5074467

CAS: 6410-87-3

LOTUS: LTS0089816

COCONUT: CNP0202058.2

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Hernandia cordigera	Hernandia	Hernandiaceae	Laurales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
None	Hernandia	Hernandiaceae	Laurales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Hernandia ovigera	Hernandia	Hernandiaceae	Laurales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
None	Hernandia	Hernandiaceae	Laurales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Molecule Weight: 309.321

TPSA？: 48.95

MolLogP？: 2.5539000000000005

Number of H-Donors: 1

Number of H-Acceptors: 5

RingCount: 6

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi