ID: 45781
SMILES:CC1=CC(c2ccc(CCCCC)cc2)C(C(O)(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -18.046
InChIKey:MXECOWWPQRFPTG-UHFFFAOYSA-N
ID: 45782
SMILES:C(C)(CCC=C(C)C)=CCc1c(O)c(C)cc(OC(=O)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.522
InChIKey:PITQHPHVMREBJR-UHFFFAOYSA-N
ID: 45783
SMILES:C1CC(C(C)=C)C(c2c(O)cc(CCCC)cc2O)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.739
InChIKey:WBRXESQKGXYDOL-UHFFFAOYSA-N
ID: 45784
SMILES:C(CC)CCc1cc2c(c(O)c1)C1CC(C)(CCC1C(C)(C)O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.841
InChIKey:UKPNRAMYBFBWKV-UHFFFAOYSA-N
ID: 45785
SMILES:C(=C(C)C)CCC(C)=CCOc1c(O)cc(CCCCC)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.108
InChIKey:HUOSBKDCWCFSDM-UHFFFAOYSA-N
ID: 45786
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1CCC(CO)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 45787
SMILES:C(c1cc(O)c(CC=C(C)CCC=C(C)CCC=C(C)C)c(O)c1)CO
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 358.522
CB1 binding score: -18.167
InChIKey:XZFAYPIJUGSPRO-UHFFFAOYSA-N
ID: 45788
SMILES:c1(O)cc2c(cc1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -20.067
InChIKey:OBJJEVJNCDBGOD-UHFFFAOYSA-N
ID: 45789
SMILES:C(CCC(C(OC)=O)CCC=C(C)C)(C)=CCc1c(O)c(C)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -16.951
InChIKey:OHPITRIUXIKUDQ-UHFFFAOYSA-N
ID: 45790
SMILES:OC(C1CC=C(CCC=C(C)C)CC1c1cc(O)cc(C)c1O)(O)CC=C(CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.678
CB1 binding score: -15.408
InChIKey:WIPJZYLGZMRGJB-UHFFFAOYSA-N
ID: 45791
SMILES:C12C(c3c(cc(CCCCC)cc3O)OC1(C)C)C=C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 45792
SMILES:C=C(C)C1CC=C(C)CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.129
InChIKey:ZTGXAWYVTLUPDT-UHFFFAOYSA-N
ID: 45793
SMILES:c1(O)c(OC2C3(C(C)=C)C(C(Cl)C2(O)C)c2c(cc(CCCCC)cc2O)O3)cccc1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.982
CB1 binding score: -15.706
InChIKey:JEJWULKJKMQONA-UHFFFAOYSA-N
ID: 45794
SMILES:c1(O)c2c(cc(CCC(CC)O)c1)OC(C)(C)C(O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 280.364
CB1 binding score: -15.393
InChIKey:UGJAPEFWVIWKLF-UHFFFAOYSA-N
ID: 45795
SMILES:C(Cc1c(CCCCC)cc(O)cc1O)=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.891
InChIKey:JFJAMLJGMDJCRJ-UHFFFAOYSA-N
ID: 45796
SMILES:c1(O)cc(CCCCC)cc2c1C1=C(C(C)(C)O2)CC(OC(C)=O)C(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -14.254
InChIKey:KXZVUXDJMVFYDY-UHFFFAOYSA-N
ID: 45797
SMILES:C1(=O)OC2C3C(C(OO)C=C3C)C(c3c(O)cc(CCCCC)cc3)(C)CC=C(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.553
CB1 binding score: -16.608
InChIKey:FHUBKFVGTVAODX-UHFFFAOYSA-N
ID: 45798
SMILES:C(C1=CC2C(C(C)(C)Oc3cc(C(=O)OC)ccc32)CC1)=CC(C)(O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -15.926
InChIKey:PTMQPOBAZRITGY-UHFFFAOYSA-N
ID: 45799
SMILES:c1c(O)c2c(c(C#CC(C)=C)c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Miscellaneous meroterpenoids
MW: 308.421
CB1 binding score: -16.204
InChIKey:GKHXFLREZVZSSP-UHFFFAOYSA-N
ID: 45800
SMILES:c12c(cc(CCCCC)cc1O)OC(CCC=C(C)C)(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.002
InChIKey:ITDDKOGKAGSKEJ-UHFFFAOYSA-N
ID: 45801
SMILES:O1c2c(c(OC(C(C)=CC)=O)ccc2C)C2C=C(C)CCC2C1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -13.568
InChIKey:OBQMHCKRXHPUDD-UHFFFAOYSA-N