Obtusine; 3-O-[6-Deoxy-3-O-methyl-β-D-glucopyranosyl-(1→4)-2,6-dideoxy-3-O-methyl-β-D-ribo-hexopyranoside]
AlkaPlorer ID: AK308340
Synonym: None
IUPAC Name: None
Structure
SMILES: COC1CC(OC2CCC3(C)C(=CCC4C3CCC3(C)C4C4OCC(C)(O)NC4C3(O)C(C)O)C2)OC(C)C1OC1OC(C)C(O)C(OC)C1O
InChI: InChI=1S/C38H63NO12/c1-18-28(41)32(46-8)29(42)34(49-18)51-30-19(2)48-26(16-25(30)45-7)50-22-11-13-35(4)21(15-22)9-10-23-24(35)12-14-36(5)27(23)31-33(38(36,44)20(3)40)39-37(6,43)17-47-31/h9,18-20,22-34,39-44H,10-17H2,1-8H3
InChIKey: FZWWJGFWAGSOCB-UHFFFAOYSA-N
Reference
CAS: 263839-28-7
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Cryptolepis obtusa | Cryptolepis | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 725.9170000000004
TPSA？: 177.79
MolLogP？: 1.7483000000000044
Number of H-Donors: 6
Number of H-Acceptors: 13
RingCount: 7
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|