(1S,8R,15R,19S)-11-ethyl-17-(2-propoxyphenyl)-17-azapentacyclo[6.6.5.0²,⁷.0⁹,¹⁴.0¹⁵,¹⁹]nonadeca-2,4,6,9(14),10,12-hexaene-16,18-dione
AlkaPlorer ID: AK190406
Synonym: None
IUPAC Name: (1R,8R,15R,19R)-4-ethyl-17-(2-propoxyphenyl)-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2(7),3,5,9,11,13-hexaene-16,18-dione
Structure
SMILES: CCCOC1=CC=CC=C1N1C(=O)[C@@H]2[C@@H]3C4=CC=CC=C4[C@H](C4=CC(CC)=CC=C43)[C@H]2C1=O
InChI: InChI=1S/C29H27NO3/c1-3-15-33-23-12-8-7-11-22(23)30-28(31)26-24-18-9-5-6-10-19(18)25(27(26)29(30)32)21-16-17(4-2)13-14-20(21)24/h5-14,16,24-27H,3-4,15H2,1-2H3/t24-,25-,26-,27-/m1/s1
InChIKey: ICPHNLDWDJYOQD-FPCALVHFSA-N
Reference
Cytotoxic Constituents of the Bark of Plumeria rubra Collected in Indonesia
PubChem CID: 163136404
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
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Properties Information
Molecule Weight: 437.5390000000002
TPSA？: 46.61
MolLogP？: 5.434400000000005
Number of H-Donors: 0
Number of H-Acceptors: 3
RingCount: 7
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
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