(19S)-19-ethyl-7-methoxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.0²,¹¹.0⁴,⁹.0¹⁵,²⁰]henicosa-1(21),2(11),3,5,7,9,15(20)-heptaen-19-yl acetate
AlkaPlorer ID: AK027846
Synonym: None
IUPAC Name: [(19S)-19-ethyl-7-methoxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2(11),3,5,7,9,15(20)-heptaen-19-yl] acetate
Structure
SMILES: CC[C@@]1(OC(C)=O)C(=O)OCC2=C1C=C1C3=NC4=CC=C(OC)C=C4C=C3CN1C2=O
InChI: InChI=1S/C23H20N2O6/c1-4-23(31-12(2)26)17-9-19-20-14(7-13-8-15(29-3)5-6-18(13)24-20)10-25(19)21(27)16(17)11-30-22(23)28/h5-9H,4,10-11H2,1-3H3/t23-/m0/s1
InChIKey: DPHRQQLBEUIERE-QHCPKHFHSA-N
Reference
New Camptothecin and Ellagic Acid Analogues from the Root Bark of<i>Camptotheca acuminata</i>
PubChem CID: 70490115
LOTUS: LTS0024514
SuperNatural Ⅲ: SN0071835-01
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Camptotheca acuminata | Camptotheca | Nyssaceae | Cornales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 420.42100000000016
TPSA？: 96.72
MolLogP？: 2.6590000000000007
Number of H-Donors: 0
Number of H-Acceptors: 8
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|