ID: 119785
SMILES:C(CCCC)c1cc2c(c(O)c1)C1(C)C(CCC(=C(C)C)C1)C2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.551
CB1 binding score: -12.589
InChIKey:IZAFWXPXXJPUJT-UHFFFAOYSA-N
ID: 119786
SMILES:CC(=CC1c2c(O)cc(CCCCC)cc2OC1(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -17.082
InChIKey:IIKPKUGVSJUDHY-UHFFFAOYSA-N
ID: 119787
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 119788
SMILES:O(C)c1c(C2C(C(=C)C)CCC(C)=C2)c(OC)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -17.878
InChIKey:UYBGHBAVRNATET-UHFFFAOYSA-N
ID: 119789
SMILES:c1(CC=C(CCC=C(C)C)C)c(O)cc(CCC)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.432
CB1 binding score: -17.127
InChIKey:OPXKVEGAXOYJHJ-UHFFFAOYSA-N
ID: 119790
SMILES:C1C2C1C(C)(C)Oc1c2c(O)cc(CCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 232.323
CB1 binding score: -16.688
InChIKey:ZVTOCVBWXYGEFC-UHFFFAOYSA-N
ID: 119791
SMILES:CC1=CC2c3c(O)c(C(=O)O)c(CCCC)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.936
InChIKey:TZFPIQSSTVIJTQ-UHFFFAOYSA-N
ID: 119792
SMILES:C1C(C)=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 119793
SMILES:C12C(C)(C)Oc3c(O)c(O)cc(CCCCCCCCCCCCCCC)c3C1CC(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 472.754
CB1 binding score: -13.469
InChIKey:HVCOVRSPFLMDBN-UHFFFAOYSA-N
ID: 119794
SMILES:c12c(C)c(CCCCC)cc(OC)c1OC1(CCCC(C)(C)C1)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.539
CB1 binding score: -15.176
InChIKey:HOROGGDUNDKHGT-UHFFFAOYSA-N
ID: 119795
SMILES:C1C(Br)C(C)(C)CC2CC3(C)Oc4cc(CCCCC)cc(O)c4C3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 421.419
CB1 binding score: -15.262
InChIKey:AJBJZFLMRFYUHY-UHFFFAOYSA-N
ID: 119796
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1C(C=C(C)CC1)C2)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -14.552
InChIKey:UXLVLGXCFMZLSE-UHFFFAOYSA-N
ID: 119797
SMILES:C12C(CCC1(C)O)C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -18.762
InChIKey:ICMJYQRNULRNTK-UHFFFAOYSA-N
ID: 119798
SMILES:C(=C(C)C)CCC(C)=CC1(O)Oc2c(c(O)cc(CCCCC)c2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: Not available
InChIKey:JPCRTTOXMBXISJ-UHFFFAOYSA-N
ID: 119799
SMILES:C(c1c(O)c(C(=O)CCc2ccc(O)c(O)c2)cc(O)c1C1C=C(C)CCC1C(C)=C)C
Pathway: Shikimates and Phenylpropanoids;Terpenoids
Superclass: Meroterpenoids;Flavonoids
Class: Cannabinoids;Chalcones
MW: 436.548
CB1 binding score: -14.109
InChIKey:RVMAWQLUKIFKLW-UHFFFAOYSA-N
ID: 119800
SMILES:c1(O)cc(CCCCC)cc2c1C1C(CC=C1C)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -18.334
InChIKey:JRPARYVCKDQCGY-UHFFFAOYSA-N
ID: 119801
SMILES:C1(O)CC(C)(C)C2(O)Oc3cc(CCCCC)cc(O)c3C12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.402
CB1 binding score: -14.692
InChIKey:PUMYXCCLCVPJKX-UHFFFAOYSA-N
ID: 119802
SMILES:C12C(C)(C)C1C1C(C)(CC2)Oc2cc(CCCCC)cc(O)c2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.513
InChIKey:AZIKMVNCPVVUFJ-UHFFFAOYSA-N
ID: 119803
SMILES:C1(C)=CC(c2c(O)cc(CCC)cc2O)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N
ID: 119804
SMILES:CC(=CCc1c(OC(C)=O)c(C)cc(O)c1)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.936
InChIKey:HBMZKHKKECAQEH-UHFFFAOYSA-N
ID: 119805
SMILES:C1(O)C2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)CCC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.898
InChIKey:SUVXTOCRTNYFMQ-UHFFFAOYSA-N