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Tetrahydrocannabivarol

CAT: 0926-FT172555-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0926-FT172555-01Size:25 mg
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CAS Number
28172-17-0
Smiles
CCCC1=CC (=C2[C@@H]3C=C (CC[C@H]3C (OC2=C1) (C) C) C) O
Molecular Formula
C19H26O2
Molecular Weight
286.41 g/mol
Controlled
Yes

Chemical Information

6a,7,8,10a-Tetrahydro-6,6,9-trimethyl-3-propyl-6H-dibenzo(b,d)pyran-1-ol

tetrahydrocannabivarin has been reported in Cannabis sativa with data available.

CAS Number28172-17-0
PubChem CID34180
IUPAC Name6,6,9-trimethyl-3-propyl-6a,7,8,10a-tetrahydrobenzo[c]chromen-1-ol
Molecular FormulaC19H26O2
Molecular Weight286.4
XLogP5.9
Topological Polar Surface Area29.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count21
Formal Charge0
Complexity412
SMILES
CCCC1=CC(=C2C3C=C(CCC3C(OC2=C1)(C)C)C)O
InChI
InChI=1S/C19H26O2/c1-5-6-13-10-16(20)18-14-9-12(2)7-8-15(14)19(3,4)21-17(18)11-13/h9-11,14-15,20H,5-8H2,1-4H3
InChIKey
ZROLHBHDLIHEMS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 6a,7,8,10a-Tetrahydro-6,6,9-trimethyl-3-propyl-6H-dibenzo(b,d)pyran-1-ol
CAS: 28172-17-0
CID: 34180
Formula: C19H26O2
MW: 286.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight286.4
XLogP35.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass286.193280068
Monoisotopic Mass286.193280068
Topological Polar Surface Area29.5 Ų
Heavy Atom Count21
Formal Charge0
Complexity412
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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