Aurantoside A
AlkaPlorer ID: AK289732
Synonym: None
IUPAC Name: None
Structure
SMILES: COC1C(OC2COC(OC3C(O)C(O)COC3N3C(=O)/C(=C(O)\C=C\C=C\C=C\C=C\C=C(Cl)\C=C(\C)Cl)C(=O)C3CC(N)=O)C(O)C2O)OC(C)C1O
InChI: InChI=1S/C36H46Cl2N2O15/c1-17(37)13-19(38)11-9-7-5-4-6-8-10-12-21(41)25-27(45)20(14-24(39)43)40(33(25)49)34-31(28(46)22(42)15-51-34)55-35-30(48)29(47)23(16-52-35)54-36-32(50-3)26(44)18(2)53-36/h4-13,18,20,22-23,26,28-32,34-36,41-42,44,46-48H,14-16H2,1-3H3,(H2,39,43)/b5-4+,8-6+,9-7+,12-10+,17-13-,19-11-,25-21+
InChIKey: NLZFTTQPFPQXDX-CYVQMNASSA-N
Reference
CAS: 137895-70-6
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Melophlus | Ancorinidae | Tetractinellida | Demospongiae | Porifera | Metazoa | Eukaryota |
| Theonella sp. | Theonella | Theonellidae | Tetractinellida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 817.6690000000001
TPSA？: 257.23
MolLogP？: -0.0087999999999956
Number of H-Donors: 7
Number of H-Acceptors: 15
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|