9-Hydroxy-10-epi-ryanodine
AlkaPlorer ID: AK115363
Synonym: '9alpha-Hydroxy-10-epiryanodine'
IUPAC Name: [(1R,2S,3R,6S,7S,9S,10S,11S,12R,13S,14R)-2,3,6,9,11,13,14-heptahydroxy-3,7,10-trimethyl-11-propan-2-yl-15-oxapentacyclo[7.5.1.01,6.07,13.010,14]pentadecan-12-yl] 1H-pyrrole-2-carboxylate
Structure
SMILES: CC(C)[C@@]1(O)[C@@H](OC(=O)C2=CC=CN2)[C@@]2(O)[C@@]3(C)C[C@]4(O)O[C@@]5([C@@H](O)[C@](C)(O)CC[C@]35O)[C@@]2(O)[C@]14C
InChI: InChI=1S/C25H35NO10/c1-12(2)22(32)16(35-14(27)13-7-6-10-26-13)23(33)18(4)11-21(31)19(22,5)25(23,34)24(36-21)15(28)17(3,29)8-9-20(18,24)30/h6-7,10,12,15-16,26,28-34H,8-9,11H2,1-5H3/t15-,16+,17+,18-,19-,20-,21-,22+,23+,24+,25+/m0/s1
InChIKey: REYPEWVSBJSDJC-YVHRWRGUSA-N
Reference
Minor constituents of Spigelia anthelmia and their cardiac activities
PubChem CID: 100991758
LOTUS: LTS0052030
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Spigelia anthelmia | Spigelia | Loganiaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 509.5520000000004
TPSA？: 192.93
MolLogP？: -1.072699999999999
Number of H-Donors: 8
Number of H-Acceptors: 10
RingCount: 7
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|