tripterospermumcin F
AlkaPlorer ID: AK009533
Synonym: None
IUPAC Name: None
Structure
SMILES: OCC([C@H](C(C1O)O)O)O[C@H]1O[C@@H]([C@@H]([C@@H]2CCOC(C3=CO[C@H]([C@@H]([C@@H]3C[C@@H]4N[C@@H](CC5=C4NC6=CC=CC=C56)C(O)=O)C(OCC7=CC=CC=C7)=C)O[C@@H]8OC([C@H](C(C8O)O)O)CO)=O)C(OCC9=CC=CC=C9)=C)OC=C2C(OC)=O
InChI: InChI=1S/C58H68N2O22/c1-28(75-24-30-12-6-4-7-13-30)43-33(36(53(71)73-3)26-77-55(43)81-57-50(67)48(65)46(63)41(22-61)79-57)18-19-74-54(72)37-27-78-56(82-58-51(68)49(66)47(64)42(23-62)80-58)44(29(2)76-25-31-14-8-5-9-15-31)34(37)20-39-45-35(21-40(59-39)52(69)70)32-16-10-11-17-38(32)60-45/h4-17,26-27,33-34,39-44,46-51,55-68H,1-2,18-25H2,3H3,(H,69,70)/t33-,34-,39+,40+,41?,42?,43-,44-,46-,47-,48?,49?,50?,51?,55+,56+,57+,58+/m1/s1
InChIKey: VAGLMHYZFNNTNG-FHKZFGCJSA-N
Reference
The novel indole glucoalkaloid and secoiridoid glucoside from Tripterospermum chinense
data_source: manually
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Tripterospermum | Gentianaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 1145.1740000000002
TPSA？: 353.4
MolLogP？: 1.3435000000000121
Number of H-Donors: 11
Number of H-Acceptors: 22
RingCount: 9
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|