ID: 105085
SMILES:c1c(C(=O)O)cc2c(c1)OC(C)(C)C1C(O)CC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.343
CB1 binding score: -14.546
InChIKey:UUHZXBOFFZHUOS-UHFFFAOYSA-N
ID: 105086
SMILES:CC(=CCc1c(O)cc(CCC)cc1O)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -19.824
InChIKey:YJYIDZLGVYOPGU-UHFFFAOYSA-N
ID: 105087
SMILES:O=C(C)Oc1c(OCC)cc2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -15.342
InChIKey:QBRJCTZJMXUXIR-UHFFFAOYSA-N
ID: 105088
SMILES:Nc1ccc(CC(CCCCCCCC)C2=C(O)C3(CC=C(C)C)OC(=O)C4=C3OC(C)(C)C4C2)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 507.715
CB1 binding score: -13.877
InChIKey:YMPJIPYTYXEGLZ-UHFFFAOYSA-N
ID: 105089
SMILES:c12ccc(OC)cc1C(C)(C)Oc1cc(CCCCC)cc(O)c1-2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -18.334
InChIKey:WBOMYILSCVRHHE-UHFFFAOYSA-N
ID: 105090
SMILES:c1(O)c(C2C=C(C)CC(O)C2C(C)=C)ccc(CCC(O)C(C)(C)O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -14.995
InChIKey:MWHSBDATRPUOOD-UHFFFAOYSA-N
ID: 105091
SMILES:C12C(CCC(C)C1)C(C)(C)Oc1c2c(O)cc(CCCCC=O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.116
InChIKey:PUYYMVCCBIOQEL-UHFFFAOYSA-N
ID: 105092
SMILES:c1(O)c(C(O)=O)c(CCCCC)cc2c1C=CC(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.359
CB1 binding score: -18.748
InChIKey:AIWWNGHRWHAXTF-UHFFFAOYSA-N
ID: 105093
SMILES:c12c(O)cc(CCCCC)cc1OC(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: 105094
SMILES:C1C(C(C)=C)C(c2c(O)cc(CCCCC)cc2O)CC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.129
InChIKey:ZTGXAWYVTLUPDT-UHFFFAOYSA-N
ID: 105095
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C(O)CCC(C)(C=C)O2)CC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: -15.565
InChIKey:GHTYITHMHIFLPM-UHFFFAOYSA-N
ID: 105096
SMILES:O(C(c1cc(O)c2c(c1CC=C(C)C)C(C)=CCC2C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -13.732
InChIKey:CKMJTYAZDIWFRZ-UHFFFAOYSA-N
ID: 105097
SMILES:c12ccc(CCC)cc1OC(C)(C)C=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 202.297
CB1 binding score: -18.334
InChIKey:WYCXEZLCPAMBFN-UHFFFAOYSA-N
ID: 105098
SMILES:C12C(C=C(C)CC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.096
InChIKey:OPOIPENSMKDQLW-UHFFFAOYSA-N
ID: 105099
SMILES:C12CC(=C)CCC1c1c(C)cc(O)cc1OC2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -13.027
InChIKey:QJEDFTKPAYMYFY-UHFFFAOYSA-N
ID: 105100
SMILES:CC(=CCCC(=CCc1c(O)cc(CCCCC)c(C(=O)O)c1O)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 105101
SMILES:C1(C)(C)C2CC(O)=C(C)CC2c2cc(O)c(C)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -14.68
InChIKey:HFXINSYKPHVYPY-UHFFFAOYSA-N
ID: 105102
SMILES:C(C)(C)=CCCC(=CCc1c(CC=C(C)C)c(O)cc(CCCCC)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.605
CB1 binding score: -16.976
InChIKey:KUQFQMZLGYOTDL-UHFFFAOYSA-N
ID: 105103
SMILES:c1(O)c2c(cc(C(O)(C)C)c1)OC(C)(C)C1C2CC(C)=CC1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -15.512
InChIKey:AKCJRPZIIKDVSU-UHFFFAOYSA-N
ID: 105104
SMILES:C12C(C(O)C(C)=CC1)c1c(cc(CCCCCC)cc1O)OC(C)(C)C2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -15.98
InChIKey:DRAULQNFJSDUJG-UHFFFAOYSA-N
ID: 105105
SMILES:C12(O)CCC(C)=CC1c1c(cc(CCCCC)cc1OC)OC(C)(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -14.718
InChIKey:CBDYSCLSWKLPRL-UHFFFAOYSA-N