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Euphorbia factor L24

CAT: 0013-GTR19237129-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19237129-01Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Reference standards. Euphorbia factor L1 analogue.
CAS Number
1613700-13-2
Purity
>98% (HPLC)
Solubility
DMSO, Pyridine, Methanol, Ethanol, etc.
Molecular Formula
C31H38O8
Molecular Weight
538.6
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

Euphorbia factor L24
CAS Number1613700-13-2
PubChem CID162639174
IUPAC Name[(1R,3Z,5R,7S,9Z,11R,12R,13S,14S)-1,11-diacetyloxy-10-(hydroxymethyl)-3,6,6,14-tetramethyl-2-oxo-13-tricyclo[10.3.0.05,7]pentadeca-3,9-dienyl] benzoate
Molecular FormulaC31H38O8
Molecular Weight538.6
XLogP4.1
Topological Polar Surface Area116
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count8
Heavy Atom Count39
Formal Charge0
Complexity1060
SMILES
C[C@H]1C[C@]2([C@H]([C@H]1OC(=O)C3=CC=CC=C3)[C@H](/C(=C\C[C@H]4[C@H](C4(C)C)/C=C(\C2=O)/C)/CO)OC(=O)C)OC(=O)C
InChI
InChI=1S/C31H38O8/c1-17-14-24-23(30(24,5)6)13-12-22(16-32)27(37-19(3)33)25-26(38-29(36)21-10-8-7-9-11-21)18(2)15-31(25,28(17)35)39-20(4)34/h7-12,14,18,23-27,32H,13,15-16H2,1-6H3/b17-14-,22-12-/t18-,23-,24+,25+,26-,27-,31+/m0/s1
InChIKey
YLLBXYRNXBAADG-OZHUUIDRSA-N
Chemical Structure
2D Structure
2D structure of Euphorbia factor L24
CAS: 1613700-13-2
CID: 162639174
Formula: C31H38O8
MW: 538.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight538.6
XLogP34.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count8
Exact Mass538.25666817
Monoisotopic Mass538.25666817
Topological Polar Surface Area116 Ų
Heavy Atom Count39
Formal Charge0
Complexity1060
Isotope Atom Count0
Defined Atom Stereocenter Count7
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count2
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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