ID: 100549
SMILES:C(CCCC)c1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 100550
SMILES:C1C(C)=CC(c2c(O)cc(CCC)cc2O)C(C(C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -20.128
InChIKey:YOJPFISTURZHJT-UHFFFAOYSA-N
ID: 100551
SMILES:COc1cc2c(c(O)c1)C1(O)C(C(C)(C)O2)CC(O)C(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.358
CB1 binding score: -16.24
InChIKey:GJWLKVJBCWUAEK-UHFFFAOYSA-N
ID: 100552
SMILES:C(C=C)c1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -19.892
InChIKey:IHDZBQSJFRBIMW-UHFFFAOYSA-N
ID: 100553
SMILES:c1c(C2C(C(C)(C)O)CCC(C)=C2)ccc(CCCCC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -18.046
InChIKey:MXECOWWPQRFPTG-UHFFFAOYSA-N
ID: 100554
SMILES:C1CC(C(C)(O)C)CC2c3c(cc(CCCCC)cc3OC2(C)C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.539
CB1 binding score: -14.065
InChIKey:KFJRPFPXQNZSHN-UHFFFAOYSA-N
ID: 100555
SMILES:C=C(C1C(c2c(O)cc(CCC)cc2O)C=C(C)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N
ID: 100556
SMILES:Oc1cc(C)cc(OC)c1C1C=C(C)C(=O)CC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -15.519
InChIKey:JVAFWUUIUDPTEU-UHFFFAOYSA-N
ID: 100557
SMILES:c1(O)c(C(Cc2ccccc2)=O)c(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1CC=C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 514.706
CB1 binding score: Not available
InChIKey:HWUQPBWMGOWLQY-UHFFFAOYSA-N
ID: 100558
SMILES:C(C1=CC2C(C(C)(C)Oc3cc(CCCCC)cc(OC)c32)C(OC)C1)C=C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.733
CB1 binding score: -13.101
InChIKey:LXKWRGJOPJGGDO-UHFFFAOYSA-N
ID: 100559
SMILES:Oc1c(C2C(C(C)=C)CCC(C)=C2)c(O)cc(C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.979
InChIKey:GKVOVXWEBSQJPA-UHFFFAOYSA-N
ID: 100560
SMILES:C(OCC)(=O)c1c(CC=C(C)CCC=C(C)C)c(O)cc(CCCCC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -12.209
InChIKey:GFGGCFITVMPSLM-UHFFFAOYSA-N
ID: 100561
SMILES:C1C=C(C(=O)O)CCC=C(C)CC2C(C(C)(C)Oc3cc(C)cc(O)c32)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -14.629
InChIKey:IFOQXZCDKZCQFC-UHFFFAOYSA-N
ID: 100562
SMILES:C(C)(C)=CCCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)C2C(CC(=O)C)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -15.153
InChIKey:WVADOGHFDOQMRN-UHFFFAOYSA-N
ID: 100563
SMILES:C1(O)C(C)=CCC2C1C(C)(C)Oc1c2c(O)cc(C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.761
InChIKey:VZJYMQAWNKKLQG-UHFFFAOYSA-N
ID: 100564
SMILES:Cc1c(C=O)c(O)c(CC=C(C)C)c(C2C(C(C)=C)CCC(C)=C2)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.491
CB1 binding score: -12.662
InChIKey:DGQNGWIWYYGLSN-UHFFFAOYSA-N
ID: 100565
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1C1C(CO)CC(C)(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -14.889
InChIKey:UOVPGEWHXUBQTG-UHFFFAOYSA-N
ID: 100566
SMILES:c1(=O)cc(C2C(C(O)(C)C)CCC(C)=C2)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.502
InChIKey:LGLOZNBVXUCRGW-UHFFFAOYSA-N
ID: 100567
SMILES:C(=O)(OC)c1c(O)c(O)c(-c2cc3c(c(C)c2O)C=CC(C)(CCC=C(C)C)O3)c(CCCCC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 494.628
CB1 binding score: -15.215
InChIKey:FJRSZNAIOMFSEQ-UHFFFAOYSA-N
ID: 100568
SMILES:CC(C)=CCCC(C)=CCc1cc(O)c(CC(C)O)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -18.306
InChIKey:QJRQZQBJSJPOFD-UHFFFAOYSA-N
ID: 100569
SMILES:c1c2c(ccc1C)OC(C)(C)C1CCC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -18.878
InChIKey:GUXGXKFPIHIMLU-UHFFFAOYSA-N