137761-17-2
AlkaPlorer ID: AK046086
Synonym: None
IUPAC Name: 13-methoxycarbonyl-11,22-diazapentacyclo[13.7.0.04,12.05,10.016,21]docosa-1(15),2,4(12),5,7,9,13,16,18,20-decaene-2-carboxylic acid
Structure
SMILES: COC(=O)C1=C2NC3=CC=CC=C3C2=CC(C(=O)O)=C2NC3=CC=CC=C3C2=C1
InChI: InChI=1S/C23H16N2O4/c1-29-23(28)17-11-15-13-7-3-4-8-18(13)24-20(15)16(22(26)27)10-14-12-6-2-5-9-19(12)25-21(14)17/h2-11,24-25H,1H3,(H,26,27)
InChIKey: HRCWZKWCFDIXMA-UHFFFAOYSA-N
Reference
Two caulerpin analogues and a sesquiterpene from Caulerpa racemosa
PubChem CID: 74052599
LOTUS: LTS0019035
COCONUT: CNP0208354
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Caulerpa racemosa | Caulerpa | Caulerpaceae | Bryopsidales | Ulvophyceae | Chlorophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 384.3910000000001
TPSA？: 95.18
MolLogP？: 0.4829999999999996
Number of H-Donors: 3
Number of H-Acceptors: 3
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|