ID: 50611
SMILES:C1(CCC(C)C)C(C)(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.474
CB1 binding score: -15.909
InChIKey:DTNVOBUSXAFULO-UHFFFAOYSA-N
ID: 50612
SMILES:c1(O)c(CCC)cc2c(c1O)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.532
InChIKey:LLRWEJCFJKNAIF-UHFFFAOYSA-N
ID: 50613
SMILES:C(Cc1c(O)c2c(cc1OC(=O)C)OC(C)(C)C1CCC(C)=CC21)CC(O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -14.886
InChIKey:OAGMMTSBIBWMQN-UHFFFAOYSA-N
ID: 50614
SMILES:Oc1cc(C)cc2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -20.957
InChIKey:WIDIPARNVYRVNW-UHFFFAOYSA-N
ID: 50615
SMILES:C12(O)c3c(O)cc(CCCCC)cc3OC1(C)CCC1C2(C)CCC(=O)C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -13.624
InChIKey:VJAYXUDHNQJYKN-UHFFFAOYSA-N
ID: 50616
SMILES:C(C(C)=CC(OC(C)=O)CC(C)=CCc1c(O)c(C)cc(O)c1)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -16.325
InChIKey:KDJQBLSXZJYVII-UHFFFAOYSA-N
ID: 50617
SMILES:C1(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C=C(COC(C)=O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -17.007
InChIKey:KDNNPXMACKUHBU-UHFFFAOYSA-N
ID: 50618
SMILES:CC(=CC1=C(CC=C(C)C)c2c(cccc2CCCC)OC1c1ccccc1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.579
CB1 binding score: -14.964
InChIKey:YJYFNKHSZSPSIC-UHFFFAOYSA-N
ID: 50619
SMILES:c1(O)ccc(CCCC)c(O)c1C1C=C(C)CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -17.486
InChIKey:LQQIXCZQOFWRDS-UHFFFAOYSA-N
ID: 50620
SMILES:c1(O)c2c(c3c(c1C(=O)C)C(C)C=C(C)C3)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.501
CB1 binding score: -15.753
InChIKey:CNTOBGLIRMLKRS-UHFFFAOYSA-N
ID: 50621
SMILES:C(C)C(C(O)c1c2c(c(O)c(C(=O)CCC)c1O)OC(C)(C)C1CC=C(C)CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -16.769
InChIKey:WAWHKOOIJJOVKB-UHFFFAOYSA-N
ID: 50622
SMILES:Oc1c2c(cc(CCCCC)c1O)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.889
InChIKey:UQZHCXRAKGTLRR-UHFFFAOYSA-N
ID: 50623
SMILES:C1(=O)C(=CCO)C2C(C(C)(C)Oc3cc(C(C)C)ccc32)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -15.566
InChIKey:NNVIGYORGCWJRO-UHFFFAOYSA-N
ID: 50624
SMILES:C1(c2c(O)cc(CCCCC)cc2)C2C(CCC1=C)C2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -15.609
InChIKey:JHTNRUSKZABJOY-UHFFFAOYSA-N
ID: 50625
SMILES:O1c2c(c(O)cc(CCCCCCC)c2)C2C1(C)C(=O)CC1(C)C(C)CCC=C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -18.606
InChIKey:FLJRQELLBIJJEJ-UHFFFAOYSA-N
ID: 50626
SMILES:C1CCC2=CC(c3c(O)cc(CCC)cc3O2)C=C(C)CCC=C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.491
CB1 binding score: -15.526
InChIKey:XLGGETLBCZGFEN-UHFFFAOYSA-N
ID: 50627
SMILES:C1(Cl)C(C)(C)Oc2cc(CCCCC)cc(O)c2C1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.794
CB1 binding score: -16.461
InChIKey:YUVYIZRPMMXPRI-UHFFFAOYSA-N
ID: 50628
SMILES:C(C)(C)(O)C=CCC1(C)C=Cc2c(O)c(C(O)=O)c(CCCCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -17.073
InChIKey:ZYLJTVCGEOJALG-UHFFFAOYSA-N
ID: 50629
SMILES:c1(OC)c2c(c(COC(CC(C)C)=O)cc1)OC(C)(C)C1C2C=C(C=O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -13.593
InChIKey:LJDGDDCFEWSUFA-UHFFFAOYSA-N
ID: 50630
SMILES:c1(C)cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -20.957
InChIKey:WIDIPARNVYRVNW-UHFFFAOYSA-N
ID: 50631
SMILES:O=C1C(CC)c2c(O)c(C(O)=O)c(CCCCC)cc2OC1CC=C(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -15.29
InChIKey:BURDTBKBEKHJKR-UHFFFAOYSA-N