ID: 43723
SMILES:c12c(cc(CCCCC)cc1)OC(C)(C)c1ccc(C)cc1-2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 294.438
CB1 binding score: -18.455
InChIKey:AKZMYJAEOJLEIA-UHFFFAOYSA-N
ID: 43724
SMILES:C12=CC(C(O)C(=C)CO)Oc3c(c(O)cc(CCCCC)c3)C1CC(C)C2=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -15.929
InChIKey:GLVOCGDJZXMIHG-UHFFFAOYSA-N
ID: 43725
SMILES:O(C)C(C1=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.943
InChIKey:CCMWHLPOQSRJEP-UHFFFAOYSA-N
ID: 43726
SMILES:C(Cc1c(CCC)c(C)cc2c1C(C)(C)O2)CC(O)(C)C#C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -16.146
InChIKey:YPBKRUBHEXWCRY-UHFFFAOYSA-N
ID: 43727
SMILES:C1=C(C(OC)=O)C2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -16.351
InChIKey:DFQOIMWRLLJEHB-UHFFFAOYSA-N
ID: 43728
SMILES:c1c(CCC)cc(O)c(C2C(C(C)(C)O)CCC(C)=C2)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -17.838
InChIKey:NMMZPZFRMUCCQT-UHFFFAOYSA-N
ID: 43729
SMILES:C1(c2c(O)cc(CCCCC)cc2O)CC2(C)CCC1(O)C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -14.179
InChIKey:BEXHZVSCIZYBOI-UHFFFAOYSA-N
ID: 43730
SMILES:C1(C)C(=C)C(c2c(O)cc(CCCCC)cc2)CC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.432
CB1 binding score: -12.543
InChIKey:OFOVZMOLZSIZCB-UHFFFAOYSA-N
ID: 43731
SMILES:c1c(CCCCC)cc2c(c1O)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 43732
SMILES:Oc1c(CCCCC)cc(C2(C)CC=CC(C)(C)O2)cc1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -15.04
InChIKey:BDJMIMIDLKWPPO-UHFFFAOYSA-N
ID: 43733
SMILES:C(CCCCC)c1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 43734
SMILES:C(=CC(C)CC(CC)C)c1ccc(C2C=C(C)CCC2C(=C)C)c(O)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -17.748
InChIKey:HBXYEQJHURXFML-UHFFFAOYSA-N
ID: 43735
SMILES:FC(F)(C(Oc1cc2c(c(C)c1)OC(CCC=C(C)C)(C)C=C2)=O)F
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.368
CB1 binding score: -17.191
InChIKey:BAHSYVHGXIYPDW-UHFFFAOYSA-N
ID: 43736
SMILES:O=CC(CCCCCCC)c1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -13.065
InChIKey:WJCIXKGGHUBDDL-UHFFFAOYSA-N
ID: 43737
SMILES:Oc1c2c(c(O)c(CC=C(CCC=C(C)C)C)c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -16.246
InChIKey:AZFQGKDQTQMEFR-UHFFFAOYSA-N
ID: 43738
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)-c2c1ccc(C)c2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 43739
SMILES:C1(CCCC(=CC(CC(C)=CCc2c(O)c(C)cc(O)c2)=O)C)C=C(C)CCC1C(C)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.636
CB1 binding score: -15.708
InChIKey:NPEPLLIMZJKKCO-UHFFFAOYSA-N
ID: 43740
SMILES:C(C1CC(CC=C(C)CC)C(C)(C)CC1c1c(O)cc(CCC)cc1O)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.592
CB1 binding score: -11.092
InChIKey:JRIHAFNGOHIXIB-UHFFFAOYSA-N
ID: 43741
SMILES:C1(C=Cc2ccccc2)C(CCC=C(C)C)(C)Oc2c(c(O)cc(CCCCC)c2)C(=O)C1C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 488.712
CB1 binding score: -12.364
InChIKey:RYXQDASYXNFHKJ-UHFFFAOYSA-N
ID: 43742
SMILES:CC(C(Cc1c2c(c(O)c3c1OC(C(C)(C)O)C3)OC(C)(C)C(O)C2)C)CC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.536
CB1 binding score: -15.994
InChIKey:BTFAQJXEWCXWKV-UHFFFAOYSA-N
ID: 43743
SMILES:C(CCCCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N