ID: 45340
SMILES:C1(=O)CCC(C)C2(Cc3c(OC(=O)C)cc(CCCCC)cc3O2)C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -14.365
InChIKey:NGJMBNRRUHJWRE-UHFFFAOYSA-N
ID: 45341
SMILES:C(C(C)=CCc1cc(OC)cc(CCCCC)c1O)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -20.224
InChIKey:CKCFKZHRTRFAPG-UHFFFAOYSA-N
ID: 45342
SMILES:c1(CCCCC)cc(O)c(C2C=C(CCC=C(C)C)C(=O)O2)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -17.365
InChIKey:TVLUJXRPTYGDHM-UHFFFAOYSA-N
ID: 45343
SMILES:C12C(c3c(cc(CCC)cc3O)O1)C(C)CO2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 234.295
CB1 binding score: -16.02
InChIKey:WBVAGBCOYCAQDK-UHFFFAOYSA-N
ID: 45344
SMILES:CC1=CC(=O)C2C(C)(C)Oc3cc(CCCCC)cc(O)c3C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.149
InChIKey:MZVJHFRWFOKBAU-UHFFFAOYSA-N
ID: 45345
SMILES:C12=C(OO)C(O)(C)CCC1C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -15.47
InChIKey:UOCBJFGVZWDRRV-UHFFFAOYSA-N
ID: 45346
SMILES:c12c(O)cc(CCCCC)cc1OC1(C)C(O2)CC2C(C)(C)C3C1C(O3)OC2=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.487
CB1 binding score: -16.124
InChIKey:JBNLIWITPDMEOE-UHFFFAOYSA-N
ID: 45347
SMILES:c1(O)c(C(OC)=O)c(CCCCC)cc2c1C=CC(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -17.656
InChIKey:RMVSYXDQHUTNPJ-UHFFFAOYSA-N
ID: 45348
SMILES:c1(C(OC)=O)c(CCCCC)cc2c(c1O)C1C(C(C)C)CCC(C)(OC)C1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.547
CB1 binding score: -12.161
InChIKey:PJVAQUVFJGHSBG-UHFFFAOYSA-N
ID: 45349
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C(C)(C1)CCC(C(C)(O)CCl)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.956
CB1 binding score: -16.638
InChIKey:VKJRSEZWASZSKM-UHFFFAOYSA-N
ID: 45350
SMILES:Oc1cc(CCCCC)cc2c1C1C(C(C)(C)O2)CC=C(C)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -19.278
InChIKey:LPBNLDPLKUJIEG-UHFFFAOYSA-N
ID: 45351
SMILES:C1C(O)CC(=C)C2(c3c(cc(CCCCC)cc3O)OC2CO)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -14.628
InChIKey:RHYHWRNMRUJYIO-UHFFFAOYSA-N
ID: 45352
SMILES:O1C(C)(CCCC(=CCCC(C)=CCc2c(O)c(C)cc(O)c2)C)CC=C(C(C)(C)O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.64
CB1 binding score: -15.289
InChIKey:JKPCDJCOQQNLRY-UHFFFAOYSA-N
ID: 45353
SMILES:C1CC(C)(C)OC(C)(c2c(O)cc(CCC(C(C)(C)O)O)cc2)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 336.472
CB1 binding score: -17.388
InChIKey:ZQUMHBPQCLCZMI-UHFFFAOYSA-N
ID: 45354
SMILES:CC(CCCC(C)=CCc1c(O)cc(Cl)c(O)c1)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.93
CB1 binding score: -17.171
InChIKey:YSGSMJRQCXPUTB-UHFFFAOYSA-N
ID: 45355
SMILES:CC1(C)Oc2cc(C)c3c(c2C1)OC(C)(C)C1CCC(C)=CCC1(C)CC3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -12.181
InChIKey:CGXSGXPCGRTSTA-UHFFFAOYSA-N
ID: 45356
SMILES:OC1c2c(CCCC(O)C)cc(C)cc2OC(C)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.392
CB1 binding score: -15.929
InChIKey:ODPCIABPSQMLOL-UHFFFAOYSA-N
ID: 45357
SMILES:C(CO)(O)C(C1(c2c(OC)cc(CCCCC)cc2O)OC1(C)CCC=C(C)C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.574
CB1 binding score: -12.106
InChIKey:WATBERNRXKUECF-UHFFFAOYSA-N
ID: 45358
SMILES:c1cc(CC=C(C)C)c(=O)c(O)c2c1OC(C)(C)C1CCC(C(O)=O)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.445
CB1 binding score: -14.913
InChIKey:WGJZJAAXWQLASK-UHFFFAOYSA-N
ID: 45359
SMILES:C(CCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CC=C(C)C1CCC(C)=C)=CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -15.152
InChIKey:CRBAQZDJHUPDMK-UHFFFAOYSA-N
ID: 45360
SMILES:C1(C)CC2C(C(C)(C)Oc3c2c(O)cc(CC)c3)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -18.253
InChIKey:YQZKSASIODXUPT-UHFFFAOYSA-N