Phyto4Health

24-Methylenecycloartanol

Representations & DB's id

ChEBI: CHEBI:1307
ChEMBL: CHEMBL376350
PubChem: 94204
IUPAC: (1S,3R,6S,8R,11S,12S,15R,16R)-7,7,12,16-tetramethyl-15-[(2R)-6-methyl-5-methylideneheptan-2-yl]pentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-ol
Standard InChI: InChI=1S/C31H52O/c1-20(2)21(3)9-10-22(4)23-13-15-29(8)25-12-11-24-27(5,6)26(32)14-16-30(24)19-31(25,30)18-17-28(23,29)7/h20,22-26,32H,3,9-19H2,1-2,4-8H3/t22-,23-,24+,25+,26+,28-,29+,30-,31+/m1/s1
Standard InChI Key: BDHQMRXFDYJGII-UEBIAWITSA-N
SMILES: C=C(C(C)C)CC[C@H]([C@H]1CC[C@@]2([C@]1(C)CC[C@@]13[C@H]2CC[C@@H]2[C@]3(C1)CC[C@@H](C2(C)C)O)C)C

Molecular propeties

AlogP: 8.41
Hydrogen bonds acceptors: 1
Hydrogen bonds donors: 1
Rotatable bonds: 5
Number of rings: 5
Molecular Weight: 440.4
Topological polar surface area: 20.2
Number of aromatic rings: 0
Fsp3: 0.935
Number of carbons: 31

Plant sources

Part of plant Plant name Ref.
PlantPapaver commutatum

In vitro data

Activity Type Activity Value Target Name UniProt ID Ref.