Sphinxolide A; 8-Demethoxy, 10-deoxy
AlkaPlorer ID: AK313924
Synonym: Reidispongiolide B
IUPAC Name: N-[11-(17-hydroxy-3,15,21,23-tetramethoxy-5,12,18,24-tetramethyl-9,27-dioxo-10,26-dioxabicyclo[23.3.1]nonacosa-1(28),5,7,13,19-pentaen-11-yl)-4,10-dimethoxy-5,9-dimethyl-6-oxododec-1-enyl]-N-methylformamide
Structure
SMILES: COC1C=CC(C)C(C(C)C(OC)C(C)CCC(=O)C(C)C(CC=CN(C)C=O)OC)OC(=O)C=CC=C(C)CC(OC)CC2=CC(=O)OC(C2)C(C)C(OC)CC(OC)C=CC(C)C(O)C1
InChI: InChI=1S/C53H85NO13/c1-34-17-15-19-50(58)67-53(40(7)52(65-14)36(3)22-25-45(56)38(5)47(63-12)18-16-26-54(8)33-55)37(4)21-24-42(60-9)31-46(57)35(2)20-23-43(61-10)32-48(64-13)39(6)49-29-41(30-51(59)66-49)28-44(27-34)62-11/h15-17,19-21,23-24,26,30,33,35-40,42-44,46-49,52-53,57H,18,22,25,27-29,31-32H2,1-14H3
InChIKey: UJNWMHQOLURZPA-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Reidispongia coerulea | Reidispongia | Phymatellidae | Tetractinellida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 944.2569999999998
TPSA？: 165.59
MolLogP？: 7.937800000000011
Number of H-Donors: 1
Number of H-Acceptors: 13
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|