Molecule

Nocardioazine B

AlkaPlorer ID: AK308008

Synonym: None

IUPAC Name: 5,25-dimethyl-12-(3-methylbut-2-enyl)-3,5,16,18-tetrazaheptacyclo[14.10.0.03,14.04,12.06,11.017,25.019,24]hexacosa-6,8,10,19,21,23-hexaene-2,15-dione

Structure

SMILES: CC(C)=CCC12CC3C(=O)N4C(CC5(C)C6=CC=CC=C6NC45)C(=O)N3C1N(C)C1=CC=CC=C12

InChI: InChI=1S/C29H32N4O2/c1-17(2)13-14-29-16-23-24(34)32-22(15-28(3)18-9-5-7-11-20(18)30-26(28)32)25(35)33(23)27(29)31(4)21-12-8-6-10-19(21)29/h5-13,22-23,26-27,30H,14-16H2,1-4H3

InChIKey: ATLREEVABDWJKO-UHFFFAOYSA-N

Reference

Cardiac glycosides from Yellow Oleander (Thevetia peruviana) seeds

Species‐Metabolite Relation Database<scp>KNAp</scp><scp>SAc</scp><scp>K</scp>and Its Multifaceted Retrieval System,<scp>KNAp</scp><scp>SAc</scp><scp>K</scp>Family

E. Teuscher und U. Lindequist: Biogene Gifte. Biologie — Chemie — Pharmakologie. 595 Seiten, 178 Abb., 57 Tab. Akademie‐Verlag, Berlin 1988. Preis: 85,— M.

PubChem CID: 76005366

COCONUT: CNP0352115.2

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Nocardiopsis sp. CMB-M0232	Nocardiopsis	Nocardiopsaceae	Streptosporangiales	Actinomycetes	Actinomycetota	None	Bacteria

Properties Information

Molecule Weight: 468.60100000000017

TPSA？: 55.89000000000001

MolLogP？: 3.981500000000002

Number of H-Donors: 1

Number of H-Acceptors: 4

RingCount: 7

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi