Pachyovatamine
AlkaPlorer ID: AK173208
Synonym: ''
IUPAC Name: (8R,21S)-16,27-dimethoxy-29,31-dioxa-7,22-diazaoctacyclo[19.9.3.14,30.110,14.115,19.03,8.025,33.028,32]hexatriaconta-1(30),2,4(34),10(36),11,13,15,17,19(35),25,27,32-dodecaen-13-ol
Structure
SMILES: COC1=CC=C2C=C1C1=C(O)C=CC(=C1)C[C@H]1NCCC3=C1C=C1OC4=C5C(=CC(OC)=C4OC1=C3)CCN[C@H]5C2
InChI: InChI=1S/C34H32N2O5/c1-38-28-6-4-19-12-24(28)23-11-18(3-5-27(23)37)13-25-22-17-30-29(15-20(22)7-9-35-25)40-33-31(39-2)16-21-8-10-36-26(14-19)32(21)34(33)41-30/h3-6,11-12,15-17,25-26,35-37H,7-10,13-14H2,1-2H3/t25-,26+/m1/s1
InChIKey: CTOXZASNPMHYIO-FTJBHMTQSA-N
Reference
Pachyovatamine, a bisbenzylisoquinoline alkaloid, and other alkaloids from Pachygone ovata
PubChem CID: 163026003
LOTUS: LTS0224504
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Pachygone ovata | Pachygone | Menispermaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 548.6390000000004
TPSA？: 81.21000000000001
MolLogP？: 6.146800000000005
Number of H-Donors: 3
Number of H-Acceptors: 7
RingCount: 8
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|