Keyword(s): Natural Toxins
Molecule Category Free-form

Structure

InChI Key RHDHLQKXFJOPEK-GVTFTIFXSA-N
Smiles CC(=O)O[C@@H]1[C@H]2CC[C@@H]3[C@@]1(C[C@@]2(C)O)[C@@H]([C@H]([C@]4([C@H]([C@]3(C)O)[C@H]([C@@H](C4(C)C)O)O)O)O)OC(=O)C
InChI
InChI=1S/C24H38O10/c1-10(25)33-18-12-7-8-13-22(6,31)15-14(27)16(28)20(3,4)24(15,32)17(29)19(34-11(2)26)23(13,18)9-21(12,5)30/h12-19,27-32H,7-9H2,1-6H3/t12-,13+,14-,15+,16+,17-,18-,19-,21-,22-,23-,24+/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C24H38O10
Molecular Weight 486.25
AlogP -0.75
Hydrogen Bond Acceptor 10.0
Hydrogen Bond Donor 6.0
Number of Rotational Bond 2.0
Polar Surface Area 173.98
Heavy Atoms 34.0

Cross References

Resources Reference
NORMAN SUSDAT
PubChem 44559347
ChemSpider 23326866.0