ID: 131230
SMILES:c1c(CCCCC)c(C2C(C(C)C)CCC(C)=C2)c(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 300.486
CB1 binding score: -17.035
InChIKey:WQWJDDRTAVAGDH-UHFFFAOYSA-N
ID: 131231
SMILES:C(CCCc1ccc2c(c1)OC(C)(C)C1CCC(C)=CC21)CCCCCC=CCC=CCC=CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 488.8
CB1 binding score: -11.909
InChIKey:KFGZBACBAXMZSA-UHFFFAOYSA-N
ID: 131232
SMILES:C1(C2=C(C(=O)C)C(O)C(O)C2(O)C)CC(C(C)C)C(c2c(OC)cc(CCCCC)cc2OC)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 514.703
CB1 binding score: -16.185
InChIKey:JOLKIQVVJJOCLU-UHFFFAOYSA-N
ID: 131233
SMILES:CC1=CC2c3c(O)cc(CCc4ccc(O)cc4)cc3OC(C)(C)C2CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.485
CB1 binding score: -16.83
InChIKey:PBEGVXRRRZSVOL-UHFFFAOYSA-N
ID: 131234
SMILES:C(Cc1cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.739
InChIKey:WBRXESQKGXYDOL-UHFFFAOYSA-N
ID: 131235
SMILES:C(C)(C1C(c2c(O)cc(CCC)cc2OC)CC(C)=CC1)(OC(=O)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -15.606
InChIKey:MLVWSTZHHBJABR-UHFFFAOYSA-N
ID: 131236
SMILES:c1(CC(=O)OC)cc(C2C(C(C)=C)CCC(C)=C2)c(OC)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -17.875
InChIKey:NRPWVIIVTVVAOO-UHFFFAOYSA-N
ID: 131237
SMILES:CCCCOc1cc(C)cc(O)c1C1CC(=O)C=C(CC=C(CCC=C(CC2C(=O)C=CC2=O)OC(C)=O)C)C1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 562.659
CB1 binding score: -14.079
InChIKey:UZOXRZASQUJIKA-UHFFFAOYSA-N
ID: 131238
SMILES:C(Cc1c2c(cc(O)c1Br)C1C(CCC(C)=C1)C(C)(C)O2)(C)CCC=C(CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 515.576
CB1 binding score: -13.627
InChIKey:YUSXVDZJVFKOGX-UHFFFAOYSA-N
ID: 131239
SMILES:C1=C(C)CC2C(C1)C(C)(C)Oc1c2ccc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.423
InChIKey:MRLLOLSGDYQJHB-UHFFFAOYSA-N
ID: 131240
SMILES:C1(C)(C)C2C(=C(C(OC)=O)CC1)c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.815
InChIKey:GRGIKXWFZPFOEK-UHFFFAOYSA-N
ID: 131241
SMILES:CC(c1cc(O)c(CC=C(C)CCC=C(C)C)c(O)c1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -18.72
InChIKey:MRWXCLDGBJQAHZ-UHFFFAOYSA-N
ID: 131242
SMILES:C1(C(O)(C)C)CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.812
InChIKey:FTDORWGKHUOHKJ-UHFFFAOYSA-N
ID: 131243
SMILES:C(=CCc1c(O)cc(CCC)cc1O)(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -19.824
InChIKey:YJYIDZLGVYOPGU-UHFFFAOYSA-N
ID: 131244
SMILES:C1(CO)(O)C(O)c2c(O)cc(CCCCC)cc2OC1(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.39
CB1 binding score: -13.06
InChIKey:YTYXECZHHDXDOY-UHFFFAOYSA-N
ID: 131245
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 131246
SMILES:CC1(C)Oc2c(cc(OC)c(C)c2)C2CC(C)=CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -17.84
InChIKey:ZXRSHEJEBYIBKK-UHFFFAOYSA-N
ID: 131247
SMILES:c1c(C)cc(O)c(C2C(C(=C)C)CCC(C)=C2)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -19.801
InChIKey:MISWBPJELUDMFI-UHFFFAOYSA-N
ID: 131248
SMILES:Oc1cc(=O)c(O)cc(O)c1C1C=C(C)CCC1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.343
CB1 binding score: -15.443
InChIKey:VTDKSZDAQVHABU-UHFFFAOYSA-N
ID: 131249
SMILES:C1CC2(C)Oc3c(c(O)cc(CCCCC)c3)C1C2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -17.312
InChIKey:JSPSTQNGVIMTKB-UHFFFAOYSA-N
ID: 131250
SMILES:c1(O)cc2c(c(CCCCC)cc1=O)OC(CCC=C(C)C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.025
InChIKey:KYAZHFDISNCFSB-UHFFFAOYSA-N