ID: 54832
SMILES:C(C(=O)c1c(O)cc(CCCCC)cc1OC)=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.607
InChIKey:DPIDBQVYGHPFSL-UHFFFAOYSA-N
ID: 54833
SMILES:C1(COC(=O)C)=CC2c3c(cc(CCCCC)c(C(=O)O)c3)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.515
CB1 binding score: -15.895
InChIKey:FEWKCINEURHDOK-UHFFFAOYSA-N
ID: 54834
SMILES:C1C2C(C)=CCC1C(C)(C)Oc1c2c(O)c(OC)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -13.836
InChIKey:VCIUNZYWKQUGPM-UHFFFAOYSA-N
ID: 54835
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 54836
SMILES:COc1c2c(c(C=O)c(CCCCC)c1)OC(C)(C)C1C2CC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -13.07
InChIKey:CBUMREDDSXLFAI-UHFFFAOYSA-N
ID: 54837
SMILES:CC(C)=CCCC(=CCC1C(C)(Cc2c(O)c(C(=O)O)c(CCCCC)cc2O)OC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.612
CB1 binding score: -14.829
InChIKey:MLXSNLYFJLQAFF-UHFFFAOYSA-N
ID: 54838
SMILES:c1(O)cc2c(cc1CCCCC)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.497
InChIKey:MPSLHJUTUUBRHL-UHFFFAOYSA-N
ID: 54839
SMILES:C(CC(C)c1c(O)cc(O)c2c1OC(C)(C)C1C2C(O)CCC1C(C)=C)(=O)C(CC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.585
CB1 binding score: -14.868
InChIKey:CBTKLIYEFLALGD-UHFFFAOYSA-N
ID: 54840
SMILES:O(c1c(OC)cc(O)c2c1C1C(C(C)(C)O2)CCC(C)=C1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -17.346
InChIKey:JKQHZBTTXNXECZ-UHFFFAOYSA-N
ID: 54841
SMILES:c12cc(CCCCC)cc(O)c1OC(CCC=C(C)C)(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.581
InChIKey:WTPLHNOHHJDOPW-UHFFFAOYSA-N
ID: 54842
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(O2)C(CC=C(C)C)C(C)=CCC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -15.467
InChIKey:YJNWHNUOHLGJFE-UHFFFAOYSA-N
ID: 54843
SMILES:C12=C(OC(CCCCC)=O)C(C)CCC1C(C)(C)Oc1c2c(O)cc(CCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -16.527
InChIKey:IBUZQFOWNWVNEM-UHFFFAOYSA-N
ID: 54844
SMILES:c1(CN)c(C=O)c(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 301.386
CB1 binding score: -17.392
InChIKey:BUFXOIHKBZMHHD-UHFFFAOYSA-N
ID: 54845
SMILES:Oc1c(N)c(CCCC)cc2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 315.457
CB1 binding score: -15.054
InChIKey:GWGQPMLPZKIEKX-UHFFFAOYSA-N
ID: 54846
SMILES:C(C1C2C(c3c(cc(CCCCC)cc3O)O1)OC(C)(C)CC2)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -14.466
InChIKey:PXXBDDADKGQKSM-UHFFFAOYSA-N
ID: 54847
SMILES:CC1(C)C2C(c3c(O)cc(CCCCC)cc3O1)CC(C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 54848
SMILES:C(CCc1cc(O)cc(CC(=O)C(CC=C(C)C)C)c1)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -13.687
InChIKey:PBMBWYBHLUOPNR-UHFFFAOYSA-N
ID: 54849
SMILES:Oc1cc(CCCCC)cc2c1C1C(C(=C)C)CCC(C)(O1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.141
InChIKey:BDFKQWLDHZHBNB-UHFFFAOYSA-N
ID: 54850
SMILES:C(C)(C1(O)C2CC(C)(Oc3cc(CCCCC)cc(O)c3C2)CC1)OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -16.234
InChIKey:XSINKXTXUPBZSQ-UHFFFAOYSA-N
ID: 54851
SMILES:C1(O)C(O)C2(C)Oc3c(c(O)cc(CCCCC)c3)C3C2C(C)(CCC3C(C)=C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -15.011
InChIKey:VXRQPWZUSLEKDN-UHFFFAOYSA-N
ID: 54852
SMILES:C(CCCCO)c1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(CO)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -18.31
InChIKey:GIKVPUJCRCQWMS-UHFFFAOYSA-N