3,6,8-Trihydroxy-4(15),10(14),11(13)-guaiatrien-12-oic acid; (1α,3β,5α,6α,8α)-form, 6-Prolyl ester
AlkaPlorer ID: AK316558
Synonym: Lanicepomine A
IUPAC Name: 2-[2,6-dihydroxy-3,8-dimethylidene-4-(pyrrolidine-2-carbonyloxy)-1,2,3a,4,5,6,7,8a-octahydroazulen-5-yl]prop-2-enoic acid
Structure
SMILES: C=C1CC(O)C(C(=C)C(=O)O)C(OC(=O)C2CCCN2)C2C(=C)C(O)CC12
InChI: InChI=1S/C20H27NO6/c1-9-7-15(23)17(11(3)19(24)25)18(16-10(2)14(22)8-12(9)16)27-20(26)13-5-4-6-21-13/h12-18,21-23H,1-8H2,(H,24,25)
InChIKey: HDPVXRRHYPQQSU-UHFFFAOYSA-N
Reference
One new sesquiterpene from Saussurea laniceps
PubChem CID: 163049006
LOTUS: LTS0078353
COCONUT: CNP0331963.1
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Saussurea laniceps | Saussurea | Asteraceae | Asterales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 377.4370000000001
TPSA？: 116.09000000000002
MolLogP？: 0.7811999999999995
Number of H-Donors: 4
Number of H-Acceptors: 6
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|