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Euphorbia factor L3

CAT: 0957-S9279-1mgSize: 1 mgDry Ice: NoHazardous: No
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CAT#:0957-S9279-1mgSize:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
218916-52-0
Synonyms
5,15-Diacetyl-3-benzoyllathyrol
Target
Apoptosis related
Applications
Apoptosis
Smiles
CC1CC2 (C (C1OC (=O) C3=CC=CC=C3) C (C (=C) CCC4C (C4 (C) C) C=C (C2=O) C) OC (=O) C) OC (=O) C
Molecular Formula
C31H38O7
Additionnal Information
Euphorbia factor L3 (5,15-Diacetyl-3-benzoyllathyrol), belonging to the lathyrane diterpenoids isolated from Caper Euphorbia Seed, shows potent cytotoxicity and induces apoptosis via the mitochondrial pathway in A549 cells.
Storage Conditions
3 years -20°C powder

Chemical Information

Diacetyl benzoyl lathyrol

Diacetyl benzoyl lathyrol is a diterpenoid.

CAS Number218916-52-0
PubChem CID10577938
IUPAC Name[(1R,3E,5R,7S,11R,12R,13S,14S)-1,11-diacetyloxy-3,6,6,14-tetramethyl-10-methylidene-2-oxo-13-tricyclo[10.3.0.05,7]pentadec-3-enyl] benzoate
Molecular FormulaC31H38O7
Molecular Weight522.6
XLogP5.6
Topological Polar Surface Area96
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count7
Rotatable Bond Count7
Heavy Atom Count38
Formal Charge0
Complexity1030
SMILES
C[C@H]1C[C@]2([C@H]([C@H]1OC(=O)C3=CC=CC=C3)[C@H](C(=C)CC[C@H]4[C@H](C4(C)C)/C=C(/C2=O)\C)OC(=O)C)OC(=O)C
InChI
InChI=1S/C31H38O7/c1-17-13-14-23-24(30(23,6)7)15-18(2)28(34)31(38-21(5)33)16-19(3)27(25(31)26(17)36-20(4)32)37-29(35)22-11-9-8-10-12-22/h8-12,15,19,23-27H,1,13-14,16H2,2-7H3/b18-15+/t19-,23-,24+,25-,26-,27-,31+/m0/s1
InChIKey
JPYYWXPAHJBKJX-VWSFRBHVSA-N
Chemical Structure
2D Structure
2D structure of Diacetyl benzoyl lathyrol
CAS: 218916-52-0
CID: 10577938
Formula: C31H38O7
MW: 522.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight522.6
XLogP35.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count7
Rotatable Bond Count7
Exact Mass522.26175355
Monoisotopic Mass522.26175355
Topological Polar Surface Area96 Ų
Heavy Atom Count38
Formal Charge0
Complexity1030
Isotope Atom Count0
Defined Atom Stereocenter Count7
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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