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Oleaside B

CAT: 0013-GTR19242826-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19242826-01Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Oleaside B is a natural product for life science research. It has been investigated in vitro for its potential biological activities, serving as a tool compound in pharmacological and biochemical studies.
CAS Number
71699-08-6
Smiles
O=C1OCC (=C1) C2CCC34C (=O) C2 (C) CCC3C5 (C) CCC (OC6OC (C) C (O) C (OC) C6O) CC5CC4
Molecular Formula
C30H44O8
Molecular Weight
532.00
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

3beta-[(6-Deoxy-3-O-methyl-beta-D-galactopyranosyl)oxy]-14-oxo-8,15-cyclo-14,15-seco-5beta-card-20(22)-enolide
CAS Number71699-08-6
PubChem CID13845827
IUPAC Name3-[6-(3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl)oxy-9,13-dimethyl-17-oxo-14-tetracyclo[11.3.1.01,10.04,9]heptadecanyl]-2H-furan-5-one
Molecular FormulaC30H44O8
Molecular Weight532.7
XLogP2.6
Topological Polar Surface Area112
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Heavy Atom Count38
Formal Charge0
Complexity1010
SMILES
CC1C(C(C(C(O1)OC2CCC3(C(C2)CCC45C3CCC(C4=O)(C(CC5)C6=CC(=O)OC6)C)C)O)OC)O
InChI
InChI=1S/C30H44O8/c1-16-23(32)25(35-4)24(33)26(37-16)38-19-6-9-28(2)18(14-19)5-11-30-12-7-20(17-13-22(31)36-15-17)29(3,27(30)34)10-8-21(28)30/h13,16,18-21,23-26,32-33H,5-12,14-15H2,1-4H3
InChIKey
SWTJRDUVJNXNMX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3beta-[(6-Deoxy-3-O-methyl-beta-D-galactopyranosyl)oxy]-14-oxo-8,15-cyclo-14,15-seco-5beta-card-20(22)-enolide
CAS: 71699-08-6
CID: 13845827
Formula: C30H44O8
MW: 532.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight532.7
XLogP32.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Exact Mass532.30361836
Monoisotopic Mass532.30361836
Topological Polar Surface Area112 Ų
Heavy Atom Count38
Formal Charge0
Complexity1010
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count12
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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