Molecule

Chimonanthine

AlkaPlorer ID: AK005457

Synonym: None

IUPAC Name: (3aR,8bR)-8b-[(3aR,8bR)-3-methyl-1,2,3a,4-tetrahydropyrrolo[2,3-b]indol-8b-yl]-3-methyl-1,2,3a,4-tetrahydropyrrolo[2,3-b]indole

Structure

SMILES: CN1CC[C@]2([C@]34CCN(C)[C@H]3NC3=CC=CC=C34)C3=CC=CC=C3N[C@H]12

InChI: InChI=1S/C22H26N4/c1-25-13-11-21(15-7-3-5-9-17(15)23-19(21)25)22-12-14-26(2)20(22)24-18-10-6-4-8-16(18)22/h3-10,19-20,23-24H,11-14H2,1-2H3/t19-,20-,21+,22+/m1/s1

InChIKey: HOYXPMHLHJOGHD-CZYKHXBRSA-N

Reference

Idiospermuline, a Trimeric Pyrrolidinoindoline Alkaloid from the Seed of Idiospermum australiense

PubChem CID: 442058

LOTUS: LTS0044678

SuperNatural Ⅲ: SN0131550-10

NPASS: NPC145754

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Aconitum ouvrardianum	Aconitum	Ranunculaceae	Ranunculales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Rosa sericea	Rosa	Rosaceae	Rosales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Cyclamen cyprium	Cyclamen	Primulaceae	Ericales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Epilachna borealis	Epilachna	Coccinellidae	Coleoptera	Insecta	Arthropoda	Metazoa	Eukaryota
Idiospermum australiense	Idiospermum	Calycanthaceae	Laurales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Properties Information

Molecule Weight: 346.47800000000007

TPSA？: 30.54

MolLogP？: 3.036600000000001

Number of H-Donors: 2

Number of H-Acceptors: 4

RingCount: 6

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi
None	Unchecked	Activity	58.3	%	10.1021/np50122a007
None	Unchecked	Activity	nan	None	10.1021/np50122a007