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Drimane

CAT: 0931-T31575-02Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0931-T31575-02Size:500 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
5951-58-6
Target
Others
Related Pathways
Others
Bioactivity
Drimane is a bicyclic sesquiterpene. It is the parent structure of many natural products with various biological activity.
Smiles
[H][C@@]12CC[C@H](C)[C@H](C)[C@@]1(C)CCCC2(C)C
Molecular Formula
C15H28
Molecular Weight
208.389
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Drimane

Drimane is a sesquiterpene and a terpenoid fundamental parent.

CAS Number5951-58-6
PubChem CID9548719
IUPAC Name(1S,2S,4aS,8aR)-1,2,5,5,8a-pentamethyl-1,2,3,4,4a,6,7,8-octahydronaphthalene
Molecular FormulaC15H28
Molecular Weight208.38
XLogP6.2
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Heavy Atom Count15
Formal Charge0
Complexity240
SMILES
C[C@H]1CC[C@@H]2[C@@]([C@H]1C)(CCCC2(C)C)C
InChI
InChI=1S/C15H28/c1-11-7-8-13-14(3,4)9-6-10-15(13,5)12(11)2/h11-13H,6-10H2,1-5H3/t11-,12-,13-,15+/m0/s1
InChIKey
CVRSZZJUWRLRDE-PWNZVWSESA-N
Chemical Structure
2D Structure
2D structure of Drimane
CAS: 5951-58-6
CID: 9548719
Formula: C15H28
MW: 208.38
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight208.38
XLogP36.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Exact Mass208.219100893
Monoisotopic Mass208.219100893
Topological Polar Surface Area0 Ų
Heavy Atom Count15
Formal Charge0
Complexity240
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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CatalogName
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