Molecule

Sporidesmin A

AlkaPlorer ID: AK040546

Synonym: None

IUPAC Name: (1R,2R,3S,11R,14R)-6-chloro-2,3-dihydroxy-7,8-dimethoxy-10,14,18-trimethyl-15,16-dithia-10,12,18-triazapentacyclo[12.2.2.01,12.03,11.04,9]octadeca-4,6,8-triene-13,17-dione

Structure

SMILES: COC1=C(OC)C2=C(C=C1Cl)[C@]1(O)[C@H](N2C)N2C(=O)[C@@]3(C)SS[C@@]2(C(=O)N3C)[C@@H]1O

InChI: InChI=1S/C18H20ClN3O6S2/c1-16-14(24)22-13-17(26,12(23)18(22,30-29-16)15(25)21(16)3)7-6-8(19)10(27-4)11(28-5)9(7)20(13)2/h6,12-13,23,26H,1-5H3/t12-,13-,16-,17-,18-/m1/s1

InChIKey: QTONANGUNATZOU-ICTVWZTPSA-N

Reference

Improved method for purification of epidithiodioxopiperazines from fungal extracts: Purification of sporidesmin A

PubChem CID: 99596

CAS: 1456-55-9

LOTUS: LTS0261748

SuperNatural Ⅲ: SN0314838-03

NPASS: NPC307010

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NPAtlas: NPA032651

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Narcissus pseudonarcissus	Narcissus	Amaryllidaceae	Asparagales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Pithomyces chartarum	Pithomyces	Astrosphaeriellaceae	Pleosporales	Dothideomycetes	Ascomycota	Fungi	Eukaryota
Veronica spuria	Veronica	Plantaginaceae	Lamiales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Matsumurella chinensis	Matsumurella	Lamiaceae	Lamiales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Baeospora myosura	Baeospora	Cyphellaceae	Agaricales	Agaricomycetes	Basidiomycota	Fungi	Eukaryota
Lepidolaena clavigera	Lepidolaena	Lepidolaenaceae	Porellales	Jungermanniopsida	Streptophyta	Viridiplantae	Eukaryota
Datura metel	Datura	Solanaceae	Solanales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Properties Information

Molecule Weight: 473.9600000000002

TPSA？: 102.78

MolLogP？: 0.8032999999999997

Number of H-Donors: 2

Number of H-Acceptors: 9

RingCount: 6

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi