ID: 82762
SMILES:CC1=CC(c2ccc(CCCCC)cc2)C(C(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.487
CB1 binding score: -19.108
InChIKey:KCGRQTUOQYSEJY-UHFFFAOYSA-N
ID: 82763
SMILES:C1C2C(c3cc(O)c(CC=C(C)C)cc31)C(C)(C)Oc1cc(CCCCC)cc(O)c1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.62
CB1 binding score: -14.627
InChIKey:IRVWOKANNHTVTC-UHFFFAOYSA-N
ID: 82764
SMILES:C(Cc1cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1CC=C(C)C)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.599
CB1 binding score: -17.219
InChIKey:IXGZRVQLNGSNJZ-UHFFFAOYSA-N
ID: 82765
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C(C1(C)C)CC(=O)C(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -19.026
InChIKey:FJVJQPVMJALOMF-UHFFFAOYSA-N
ID: 82766
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1C2CC(CO)=CC1)(C)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -15.601
InChIKey:PHMAYXICKWGLBE-UHFFFAOYSA-N
ID: 82767
SMILES:CC1=CC2C(CC1)C(C)(C)Oc1cc(CCc3ccccc3)ccc1-2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.487
CB1 binding score: -15.526
InChIKey:QLOLCOZOAXECQF-UHFFFAOYSA-N
ID: 82768
SMILES:Cc1cc(O)c2c(c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.913
InChIKey:USHZBDBBZHEKPJ-UHFFFAOYSA-N
ID: 82769
SMILES:C(c1cc(O)c(CC(Cl)C(C)=C)c(O)c1)CCCCC
Pathway: Polyketides
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 296.838
CB1 binding score: -16.243
InChIKey:SOBSVNQBFLWICL-UHFFFAOYSA-N
ID: 82770
SMILES:c12c(cc(CCCCC)cc1O)C(C1C(C(CCC=C(C)C)C)CCC(C)=C1)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -13.821
InChIKey:TWIZHTCGIUSXAB-UHFFFAOYSA-N
ID: 82771
SMILES:CC1(C)C2C(c3c(cc(CCCCC)cc3O)O1)C(O)C(C)=C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -14.704
InChIKey:WBXOMWVKYREFTF-UHFFFAOYSA-N
ID: 82772
SMILES:Oc1c(C(O)=O)c(O)c2c(c1C(CC(C)CCCC(C)C)O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 460.611
CB1 binding score: -12.532
InChIKey:CXNJDBBALUEOGC-UHFFFAOYSA-N
ID: 82773
SMILES:C1(C)(C)C2C1C1C(C)(Oc3cc(CCCCC)cc(O)c31)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.347
InChIKey:BESBHHIUFZITCL-UHFFFAOYSA-N
ID: 82774
SMILES:C(C(c1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2)C)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.237
InChIKey:KKGZGBIZOKJVGJ-UHFFFAOYSA-N
ID: 82775
SMILES:C(Cc1cc(C2C=C(C)CCC2C(=C)C)c(O)cc1)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.524
CB1 binding score: -15.325
InChIKey:NLZCLTQQJIFFJV-UHFFFAOYSA-N
ID: 82776
SMILES:CCCCCc1cc(O)c(CC2C3(C)C(C(C)(C)CC(=O)C3)CCC2=C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -14.329
InChIKey:XNTADSBRQUWAKO-UHFFFAOYSA-N
ID: 82777
SMILES:CC12C3C(C(C(C)C)CC1)(O2)Oc1c3c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.116
InChIKey:VMSHLZRRMMZCJW-UHFFFAOYSA-N
ID: 82778
SMILES:C(=C)(C=CC(C(C)C)C)C1CC=C(C)C(=Nc2c(O)cc(CCCCC)cc2O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 409.614
CB1 binding score: -11.405
InChIKey:GSUMJESIYBGGAK-UHFFFAOYSA-N
ID: 82779
SMILES:C(CCC=C(C)C(=O)C=CC(C)(C)O)(=CCc1c(O)cc(CCc2ccc(OC)c(OC)c2)cc1O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 508.655
CB1 binding score: -15.62
InChIKey:GRRSQBJZYUABOP-UHFFFAOYSA-N
ID: 82780
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)c1c-2cccc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.41
CB1 binding score: -17.752
InChIKey:CJFQORFGFVBCSD-UHFFFAOYSA-N
ID: 82781
SMILES:C1=C(C)CCC2C1C(C)(C)Oc1cc(CCCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -15.854
InChIKey:LCTNRYLVUVEXLN-UHFFFAOYSA-N
ID: 82782
SMILES:C(c1cc(O)c(CC=C(C)CCC=C(C)C)c(O)c1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -19.824
InChIKey:YJYIDZLGVYOPGU-UHFFFAOYSA-N