(1R,8S,15R,19R)-17-(3-chlorophenyl)-4-isopropyl-17-azapentacyclo[6.6.5.0²,⁷.0⁹,¹⁴.0¹⁵,¹⁹]nonadeca-2,4,6,9,11,13-hexaene-16,18-dione
AlkaPlorer ID: AK000099
Synonym: None
IUPAC Name: (1R,8R,15R,19S)-17-(3-chlorophenyl)-4-propan-2-yl-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: CC(C)C1=CC=C2C(=C1)[C@H]1C3=CC=CC=C3[C@H]2[C@@H]2C(=O)N(C3=CC=CC(Cl)=C3)C(=O)[C@H]12
InChI: InChI=1S/C27H22ClNO2/c1-14(2)15-10-11-20-21(12-15)23-19-9-4-3-8-18(19)22(20)24-25(23)27(31)29(26(24)30)17-7-5-6-16(28)13-17/h3-14,22-25H,1-2H3/t22-,23-,24+,25-/m1/s1
InChIKey: KFLDMLOZOOUTGG-ZKGSSEMHSA-N
Reference
Euphorbesulins A–P, Structurally Diverse Diterpenoids from <i>Euphorbia esula</i>
PubChem CID: 163142286
Source
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Properties Information
Molecule Weight: 427.9310000000001
TPSA？: 37.38
MolLogP？: 5.860000000000006
Number of H-Donors: 0
Number of H-Acceptors: 2
RingCount: 7
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
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