ID: 2059
SMILES:c1(CCCC)c(C)c(O)c2c(c1O)OC(C)(C)C1C2C=C(C(OC)=O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -14.943
InChIKey:BBHVBBFNHJSLFA-UHFFFAOYSA-N
ID: 2060
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: 2061
SMILES:C(C=C(C(O)NC(C(O)=O)C(C)C)C(C)(C)C)Oc1c2c3c(c(C)c1)OC(C)(C)C1CCC(C)(C21)O3
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 501.664
CB1 binding score: -13.905
InChIKey:GUWFKXHVKXLVLV-UHFFFAOYSA-N
ID: 2062
SMILES:C1(C)=CC(c2c(OC)ccc(CC[N+](O)(C)C)c2)C(C(C)=C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.492
CB1 binding score: -17.083
InChIKey:APHOZERXLQQVOV-UHFFFAOYSA-N
ID: 2063
SMILES:c1c2c(cc(CCCCC)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.189
InChIKey:AIOSXAOKGBOYPS-UHFFFAOYSA-N
ID: 2064
SMILES:C12(C(O)C(C(C)=C)CC(=O)C1C)c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.74
InChIKey:BNHUVFISSGCQAX-UHFFFAOYSA-N
ID: 2065
SMILES:C1CC2(C)C(CCC(C)=CCCC3(C)C1O3)c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -14.912
InChIKey:NHDPYKBNEPALLP-UHFFFAOYSA-N
ID: 2066
SMILES:C1(c2c(O)cc(CCCCC)cc2O)C(C(CCCC(C)C)C)CC=C(C)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -16.614
InChIKey:IJXULRMMPLUCER-UHFFFAOYSA-N
ID: 2067
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1CC=C(C)C(O)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.186
InChIKey:KQQMZTULVOWZJR-UHFFFAOYSA-N
ID: 2068
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C(=O)O)C=C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -17.53
InChIKey:BYWJGPUAYWVRDL-UHFFFAOYSA-N
ID: 2069
SMILES:COc1cc2c(cc1CC(C)=CCc1cc(O)cc(C)c1O)OC(C)(C)C(=O)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.483
CB1 binding score: -14.905
InChIKey:GMGGXPPHAXVRSB-UHFFFAOYSA-N
ID: 2070
SMILES:c12c(O)cc(CCCC)cc1OC(C)(C)c1c-2cc(C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.41
CB1 binding score: -19.327
InChIKey:GGVVJZIANMUEJO-UHFFFAOYSA-N
ID: 2071
SMILES:CC1(CCC=C(Cc2occ(C)c2)C)c2c(O)cc(CCCCC)cc2CC(C)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.609
CB1 binding score: -17.382
InChIKey:FYTOUWMAQSXGSR-UHFFFAOYSA-N
ID: 2072
SMILES:C1CCCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -17.755
InChIKey:WOBHTPOEGJUDEV-UHFFFAOYSA-N
ID: 2073
SMILES:C1(=C)CC2C(CC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.055
InChIKey:AOYYFUGUUIRBML-UHFFFAOYSA-N
ID: 2074
SMILES:C1C(C(=C)C)CCc2c(CCCC(CCCC(C(=O)O)C)(C)O)cc(O)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -16.212
InChIKey:BYINAQGIBCOWHD-UHFFFAOYSA-N
ID: 2075
SMILES:C(C)c1c2c(cc(O)c1)OC(CCC=C(C)CCC=C(C)C)(C)C=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -16.015
InChIKey:UCXXAUBLIWLUPV-UHFFFAOYSA-N
ID: 2076
SMILES:C(CCC)Cc1cc2c(cc1)C1C(=O)C(C)(C)OC(C)(C)C1CC=C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -13.81
InChIKey:HYWFVPAATGDYGM-UHFFFAOYSA-N
ID: 2077
SMILES:CC1(CCC=C(C)C)C(O)Cc2c(O)c(C(=O)O)c(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -17.467
InChIKey:KSAFPPBVVHMLQY-UHFFFAOYSA-N
ID: 2078
SMILES:C1(=O)CCC2=C1C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -15.929
InChIKey:HMRTWUMNFMMCMQ-UHFFFAOYSA-N
ID: 2079
SMILES:CC(=O)OC1CC(C)C(CCCC=C(C)CCC=C(C)C)(C)Oc2c1c(O)cc(CCCCC)c2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 484.721
CB1 binding score: -17.186
InChIKey:NYRXHOXLDWMTOI-UHFFFAOYSA-N