ID: 44752
SMILES:C(C(c1c(O)cc2c(c1O)OC(C)(C)C1CC=C(C)CC21)C)CC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -15.128
InChIKey:CODSBJNSFAFLFP-UHFFFAOYSA-N
ID: 44753
SMILES:C1CC(C)(C)Oc2c(c(O)cc(CCCCC)c2O)C1OC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 308.418
CB1 binding score: -15.96
InChIKey:KVNLBBYPIJLBSP-UHFFFAOYSA-N
ID: 44754
SMILES:C1(C=C)C(C)Oc2cc(CCCCC)cc(OC)c2C1C(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -13.196
InChIKey:HEAHIDRKAWRMFX-UHFFFAOYSA-N
ID: 44755
SMILES:C1(C)(C)C2CCC(C)C23c2c(cc(CCCCC)cc2O1)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -15.772
InChIKey:BFYPOKSPLZKULE-UHFFFAOYSA-N
ID: 44756
SMILES:CC1(C(CC=C(C)C)=O)Oc2c(c(O)cc(CCCCC)c2)C2C=C(C(O)=O)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.553
CB1 binding score: -14.933
InChIKey:FBLRRUVZZCPMHG-UHFFFAOYSA-N
ID: 44757
SMILES:c12ccc(CS)cc1C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.429
CB1 binding score: -15.651
InChIKey:YNHBUZUNIAZJPA-UHFFFAOYSA-N
ID: 44758
SMILES:C1CC(C)(C(=O)O)C2C(c3c(O)cc(CCCCC)cc31)OC(C)(C)C2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -13.741
InChIKey:TYUNAKJHMBRBIJ-UHFFFAOYSA-N
ID: 44759
SMILES:O=C(O)C1=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 44760
SMILES:C(CCCC)Cc1cc2c(c(OC)c1)C1C(C(O)(C)C)CCC(C)C1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.538
CB1 binding score: -16.015
InChIKey:KHJAYFSYZZXXSK-UHFFFAOYSA-N
ID: 44761
SMILES:CCCCCCc1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -18.609
InChIKey:HAKUWGCTBUVNJQ-UHFFFAOYSA-N
ID: 44762
SMILES:CC(CCCCCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.669
CB1 binding score: -16.038
InChIKey:WUETYFCLFTUAGZ-UHFFFAOYSA-N
ID: 44763
SMILES:C(=O)(C1=CC2c3c(cc(CCCCC)c(C(=O)OC)c3O)OC(C)(C)C2CC1)C(CCCC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.65
CB1 binding score: -14.767
InChIKey:MQTYQWQEZWGGTO-UHFFFAOYSA-N
ID: 44764
SMILES:O=CC1=C2OC(CC1)C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -15.384
InChIKey:SKWZICOZCLOMOQ-UHFFFAOYSA-N
ID: 44765
SMILES:C12C(CCC1(O)C)C(C)(C)Oc1c(c(O)cc(C)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -17.351
InChIKey:DAUOTHIBRUWCJV-UHFFFAOYSA-N
ID: 44766
SMILES:C1(C)(C)C2CCC(C)=CC2c2c(cc(C(C(C)C(C)=O)=O)c(O)c2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: Not available
InChIKey:CFHRUPGJVHEPJC-UHFFFAOYSA-N
ID: 44767
SMILES:C1(OC(C)=O)C(=O)C(C)=C2OC(C)(C)c3c2c(CCCCC)cc(OCC=C)c31
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.499
CB1 binding score: -17.04
InChIKey:WBZMVESMQMRUTD-UHFFFAOYSA-N
ID: 44768
SMILES:c1(CC2C(C)(O)CCC(C(=C)C)C2)ccc(O)cc1CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -14.111
InChIKey:DEMMPILLAZLWTB-UHFFFAOYSA-N
ID: 44769
SMILES:C(=O)(C(C)C)c1c(CCCCC)cc(O)c2c1OC(C)(CCC=C(C)C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.575
CB1 binding score: -15.598
InChIKey:RSYSKYFTWLVLEQ-UHFFFAOYSA-N
ID: 44770
SMILES:C1(O)C(OCC2(C)Oc3c(O)cc(CCCCC)cc3O2)OC(C)C(C2C(C)(C)CCC=C2C)=C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 486.649
CB1 binding score: -15.323
InChIKey:QMDDRKQRRXENGG-UHFFFAOYSA-N
ID: 44771
SMILES:C(C)(CC(=O)OCC=Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(CO)=CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.515
CB1 binding score: -15.897
InChIKey:FYLLHMQIRAFJCT-UHFFFAOYSA-N
ID: 44772
SMILES:C(CC=C(C)C)C(C)=CCc1c(OC(C(C)C)=O)cc(CCCCCO)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.575
CB1 binding score: -16.438
InChIKey:LVWNIYXVGXAHRM-UHFFFAOYSA-N