Molecule

Cyclopiamide A; N8-(3-Oxobutanoyl)

AlkaPlorer ID: AK055735

Synonym: Speradine H

IUPAC Name: 5,5,13-trimethyl-4-(3-oxobutanoyl)-4,13-diazatetracyclo[6.6.1.02,6.012,15]pentadeca-1(15),2(6),7,9,11-pentaene-3,14-dione

SMILES: CC(=O)CC(=O)N1C(=O)C2=C(C=C3C=CC=C4C3=C2C(=O)N4C)C1(C)C

InChI: InChI=1S/C20H18N2O4/c1-10(23)8-14(24)22-19(26)16-12(20(22,2)3)9-11-6-5-7-13-15(11)17(16)18(25)21(13)4/h5-7,9H,8H2,1-4H3

InChIKey: QOMBZTMIYJDJFP-UHFFFAOYSA-N

PubChem CID: 139584147

LOTUS: LTS0245539

COCONUT: CNP0354408

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NPAtlas: NPA003791

data_source: manually

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Aspergillus oryzae	Aspergillus	Aspergillaceae	Eurotiales	Eurotiomycetes	Ascomycota	Fungi	Eukaryota
Penicillium commune	Penicillium	Aspergillaceae	Eurotiales	Eurotiomycetes	Ascomycota	Fungi	Eukaryota

Molecule Weight: 350.37400000000014

TPSA？: 74.76

MolLogP？: 2.626400000000001

Number of H-Donors: 0

Number of H-Acceptors: 4

RingCount: 4

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi