(1E)-3,17,17-trimethyl-7-methylidene-15-azatricyclo[8.5.2.0¹³,¹?]heptadeca-1,14-diene-5,14,16-triol
AlkaPlorer ID: AK146620
Synonym: None
IUPAC Name: (5R,10S)-5,16-dihydroxy-3,17,17-trimethyl-7-methylidene-15-azatricyclo[8.5.2.013,16]heptadec-1-en-14-one
Structure
SMILES: C=C1CC[C@@H]2CCC3C(O)=NC(=CC(C)C[C@@H](O)C1)C3(O)C2(C)C
InChI: InChI=1S/C20H31NO3/c1-12-5-6-14-7-8-16-18(23)21-17(20(16,24)19(14,3)4)11-13(2)10-15(22)9-12/h11,13-16,22,24H,1,5-10H2,2-4H3,(H,21,23)/t13?,14-,15+,16?,20?/m1/s1
InChIKey: XOASOLHOOJVMAH-FFOGIURMSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Conglomeratusclera coerulea | Conglomeratusclera | Xeniidae | Malacalcyonacea | Anthozoa | Cnidaria | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 333.4720000000001
TPSA？: 73.05000000000001
MolLogP？: 3.751100000000002
Number of H-Donors: 3
Number of H-Acceptors: 3
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|