Phalloidin, 1-glycine-
Basic information
- CAS
64470-53-7- Standard SMILES
C[C@@H]1NC(=O)[C@@H]2C[C@H](O)CN2C(=O)[C@@H]2CSc3[nH]c4ccccc4c3CC(NC1=O)C(=O)N[C@@H](C[C@@](C)(O)CO)C(=O)NCC(=O)N[C@H]([C@H](C)O)C(=O)N2- InChIKey
UXMQFNZFEJEMIG-OGOVDGMBSA-N- Molecular formula
- C34H46N8O11S
- Average molar mass
- 774.8 g/mol
- Monoisotopic mass
- 774.30067549
Names & identifiers
- Preferred name
- Phalloidin, 1-glycine-
- IUPAC
- (14R,18S,20S,23S,28S,34R)-28-[(2R)-2,3-dihydroxy-2-methylpropyl]-18-hydroxy-34-[(1S)-1-hydroxyethyl]-23-methyl-12-thia-10,16,22,25,27,30,33,36-octazapentacyclo[12.11.11.03,11.04,9.016,20]hexatriaconta-3(11),4,6,8-tetraene-15,21,24,26,29,32,35-heptone
Names & synonyms
Phalloidin, 1-glycine-64470-53-7RefChem:10946511-GlycinephalloidinGly1-phalloidinGly(1)-phallodinBRN 5800739
Database identifiers
- CAS
64470-53-7- PubChem CID
- 198474
Properties
Computed structural properties
- XLogP
- -2.1
- Topological polar surface area
- 317 Ų
- Hydrogen bond donors
- 11
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 4
- Heavy atoms
- 54
- Formal charge
- 0
- Complexity
- 1,470
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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