Basic information
- CAS
51151-93-0- Standard SMILES
COC12CC34CCCN3CC(O1)c1cc3c(cc1C4C2O)OCO3- InChIKey
KYTDBKDWDOVRLJ-UHFFFAOYSA-N- Molecular formula
- C18H21NO5
- Average molar mass
- 331.4 g/mol
- Monoisotopic mass
- 331.14197277
Overview
Cephalotaxine, 2,11-epoxy-1,2-dihydro-, (2alpha,11alpha)- has been reported in Cephalotaxus fortunei and Cephalotaxus hainanensis with data available.
Names & identifiers
- Preferred name
- Cephalotaxine, 2,11-epoxy-1,2-dihydro-, (2alpha,11alpha)-
- IUPAC
- 13-methoxy-5,7,21-trioxa-19-azahexacyclo[11.7.1.02,10.04,8.011,15.015,19]henicosa-2,4(8),9-trien-12-ol
Names & synonyms
KYTDBKDWDOVRLJ-UHFFFAOYSA-N51151-93-0ZBA68657NSC166066AKOS032949096NSC-166066Cephalotaxine, 2,11-epoxy-1,2-dihydro-, (2.alpha.,11.alpha.)-Cephalotaxine, 7,15-epoxy-7,8-dihydro-, (7.alpha.,15.alpha.)-2,9-Epoxy-4H-cyclopenta[a][1,3]dioxolo[4,5-h]pyrrolo[2,1-b][3]benzazepine, cephalotaxine deriv.
Database identifiers
- CAS
51151-93-0- PubChem CID
- 424504
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 60.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 1
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 560
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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