Phalloidin
AlkaPlorer ID: AK032364
Synonym: None
IUPAC Name: (1S,13S,17S,19S,22S,27S,30S,33S)-27-[(2R)-2,3-dihydroxy-2-methylpropyl]-17-hydroxy-33-[(1R)-1-hydroxyethyl]-22,30-dimethyl-11-thia-9,15,21,24,26,29,32,35-octazapentacyclo[11.11.11.02,10.03,8.015,19]pentatriaconta-2(10),3,5,7-tetraene-14,20,23,25,28,31,34-heptone
Structure
SMILES: C[C@@H]1N=C(O)[C@H](C[C@@](C)(O)CO)N=C(O)[C@H]2N=C(O)[C@H](C)N=C(O)[C@@H]3C[C@H](O)CN3C(=O)[C@@H](CSC3=C2C2=CC=CC=C2N3)N=C(O)[C@H]([C@@H](C)O)N=C1O
InChI: InChI=1S/C34H46N8O11S/c1-14-26(46)40-24(16(3)44)30(50)38-21-12-54-32-23(18-7-5-6-8-19(18)39-32)25(31(51)37-20(28(48)35-14)10-34(4,53)13-43)41-27(47)15(2)36-29(49)22-9-17(45)11-42(22)33(21)52/h5-8,14-17,20-22,24-25,39,43-45,53H,9-13H2,1-4H3,(H,35,48)(H,36,49)(H,37,51)(H,38,50)(H,40,46)(H,41,47)/t14-,15-,16+,17-,20-,21+,22-,24-,25-,34+/m0/s1
InChIKey: MWJMKONRVQLRKE-UGZLBJHLSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Amanita phalloides | Amanita | Amanitaceae | Agaricales | Agaricomycetes | Basidiomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 774.8540000000002
TPSA？: 312.56000000000006
MolLogP？: 1.426100000000004
Number of H-Donors: 11
Number of H-Acceptors: 12
RingCount: 5