Molecule

Cycloposine

AlkaPlorer ID: AK116635

Synonym: None

IUPAC Name: (2R,3R,4S,5S,6R)-2-[(3S,3'R,3'aS,6'S,6aS,6bS,7'aR,9R,11aS,11bR)-3',6',10,11b-tetramethylspiro[2,3,4,6,6a,6b,7,8,11,11a-decahydro-1H-benzo[a]fluorene-9,2'-3a,4,5,6,7,7a-hexahydro-3H-furo[3,2-b]pyridine]-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol

Structure

SMILES: CC1=C2C[C@H]3[C@@H](CC=C4C[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)CC[C@@]43C)[C@@H]2CC[C@]12O[C@@H]1C[C@H](C)CN[C@H]1[C@H]2C

InChI: InChI=1S/C33H51NO7/c1-16-11-25-27(34-14-16)18(3)33(41-25)10-8-21-22-6-5-19-12-20(7-9-32(19,4)24(22)13-23(21)17(33)2)39-31-30(38)29(37)28(36)26(15-35)40-31/h5,16,18,20-22,24-31,34-38H,6-15H2,1-4H3/t16-,18+,20-,21-,22-,24-,25+,26+,27-,28+,29-,30+,31+,32-,33-/m0/s1

InChIKey: OSOOWXRUSUHLOX-PBFVMIKGSA-N

Reference

Teratogenic compounds of Veratrum californicum (Durand) VII. The structure of the glycosidic alkaloid cycloposine

PubChem CID: 25078000

CAS: 23185-94-6

LOTUS: LTS0190575

SuperNatural Ⅲ: SN0274182-01

NPASS: NPC297058

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Phlomis samia	Phlomis	Lamiaceae	Lamiales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Albizia julibrissin	Albizia	Fabaceae	Fabales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Gloriosa superba	Gloriosa	Colchicaceae	Liliales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Stevia isomeca	Stevia	Asteraceae	Asterales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Botryotrichum peruvianum	Botryotrichum	Chaetomiaceae	Sordariales	Sordariomycetes	Ascomycota	Fungi	Eukaryota
Leucopaxillus giganteus	Leucopaxillus	Tricholomataceae	Agaricales	Agaricomycetes	Basidiomycota	Fungi	Eukaryota

Properties Information

Molecule Weight: 573.7710000000003

TPSA？: 120.64

MolLogP？: 2.8261000000000003

Number of H-Donors: 5

Number of H-Acceptors: 8

RingCount: 7

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi
None	Unchecked	EC50	700.0	nM	10.1016/j.bmc.2010.07.038