Molecule

Fulvine

AlkaPlorer ID: AK032880

Synonym: '', 'Fulvine'

IUPAC Name: (1R,4R,5S,6S,16R)-5-hydroxy-4,5,6-trimethyl-2,8-dioxa-13-azatricyclo[8.5.1.013,16]hexadec-10-ene-3,7-dione

Structure

SMILES: C[C@@H]1C(=O)OCC2=CCN3CC[C@@H](OC(=O)[C@H](C)[C@@]1(C)O)[C@@H]23

InChI: InChI=1S/C16H23NO5/c1-9-14(18)21-8-11-4-6-17-7-5-12(13(11)17)22-15(19)10(2)16(9,3)20/h4,9-10,12-13,20H,5-8H2,1-3H3/t9-,10+,12-,13-,16+/m1/s1

InChIKey: PSUFRPOAICRSTC-ZLGRWFNRSA-N

Reference

Alkaloids of Crotalaria crispata F. Muell. ex Benth., The Structures of Crispatine and Fulvine

PubChem CID: 442726

CAS: 6029-87-4

LOTUS: LTS0035655

SuperNatural Ⅲ: SN0294241-08

NPASS: NPC308013

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Crotalaria madurensis	Crotalaria	Fabaceae	Fabales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Adonis amurensis	Adonis	Ranunculaceae	Ranunculales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Crotalaria crispata	Crotalaria	Fabaceae	Fabales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Crotalaria paniculata	Crotalaria	Fabaceae	Fabales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Properties Information

Molecule Weight: 309.362

TPSA？: 76.07

MolLogP？: 0.4925

Number of H-Donors: 1

Number of H-Acceptors: 6

RingCount: 3

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi