Abn-CBD

CAT: 0931-T22539-03Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0931-T22539-03Size:10 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

22972-55-0

Target

Others

Related Pathways

Others

Bioactivity

GPR55 cannabinoid receptor agonist

Smiles

C(C)(=C)[C@H]1[C@@H](C=C(C)CC1)C2=C(CCCCC)C=C(O)C=C2O

Molecular Formula

C21H30O2

Molecular Weight

314.46

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

Abnormal Cannabidiol

CAY10429 is a monoterpenoid.

CAS Number	22972-55-0
PubChem CID	89949
IUPAC Name	4-[(1R,6R)-3-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-yl]-5-pentylbenzene-1,3-diol
Molecular Formula	C21H30O2
Molecular Weight	314.5
XLogP	6.5
Topological Polar Surface Area	40.5
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	6
Heavy Atom Count	23
Formal Charge	0
Complexity	426

SMILES

CCCCCC1=C(C(=CC(=C1)O)O)[C@@H]2C=C(CC[C@H]2C(=C)C)C

InChI

InChI=1S/C21H30O2/c1-5-6-7-8-16-12-17(22)13-20(23)21(16)19-11-15(4)9-10-18(19)14(2)3/h11-13,18-19,22-23H,2,5-10H2,1,3-4H3/t18-,19+/m0/s1

InChIKey

YWEZXUNAYVCODW-RBUKOAKNSA-N

Chemical Structure

2D Structure

CAS: 22972-55-0

CID: 89949

Formula: C21H30O2

MW: 314.5

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	314.5
XLogP3	6.5
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	6
Exact Mass	314.224580195
Monoisotopic Mass	314.224580195
Topological Polar Surface Area	40.5 Å²
Heavy Atom Count	23
Formal Charge	0
Complexity	426
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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