ID: 82741
SMILES:C1=C(C)CCC2C(C)(C)Oc3cc(CCCCC)c(OC)cc3C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -13.764
InChIKey:JZVWHCZOXLSZLU-UHFFFAOYSA-N
ID: 82742
SMILES:CC1(C)Oc2cc(C)c(OC)cc2C2C=C(C)CCC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -19.208
InChIKey:DBJJYKXSZRYDDY-UHFFFAOYSA-N
ID: 82743
SMILES:C1C(C)(C#C)CC=C2C(C1)c1c(OC)cccc1OC2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.41
CB1 binding score: -15.929
InChIKey:DDHRFJHFYBXWFL-UHFFFAOYSA-N
ID: 82744
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1C2CC(C=O)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -18.255
InChIKey:BGIBNWZALWRTHR-UHFFFAOYSA-N
ID: 82745
SMILES:C1C(C)=C2C(CC1(O)C)C(C)(C)Oc1c(c(O)cc(C)c1)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -14.812
InChIKey:SHUBHGXSQYDARW-UHFFFAOYSA-N
ID: 82746
SMILES:C1C2(c3c(cc(CCCCC)cc3O)OC2(C)C)OC(=O)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -14.84
InChIKey:WBCIBZJRNNIUHZ-UHFFFAOYSA-N
ID: 82747
SMILES:Oc1c2c(cc(CCCC)c1)-c1c(ccc(O)c1)OC2(C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -17.299
InChIKey:STKBZCXYLHWOIG-UHFFFAOYSA-N
ID: 82748
SMILES:c1(CCC)cc(O)c(C2C=C(CO)CCC2C(C)=C)c(C=CC(O)=O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -15.859
InChIKey:RIHXCQLWSRIPGJ-UHFFFAOYSA-N
ID: 82749
SMILES:C1C(C)=CC(c2c(O)cc(CCC)cc2O)C(C(C)=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N
ID: 82750
SMILES:C1(O)(CO)CCC(C(C)=C)C(c2c(O)cc(CCCC)cc2O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -12.594
InChIKey:IBCNJHWBTKAYRW-UHFFFAOYSA-N
ID: 82751
SMILES:C(CCCC(OCC1C(C)OC(C)(C)C(O)C1)=O)c1cc(O)c(O)c(O)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.453
CB1 binding score: -14.677
InChIKey:XSPHVKWGTGLQQM-UHFFFAOYSA-N
ID: 82752
SMILES:C1(C)CC(C(=C)C=O)C(CO)C12CC(C(C)CCCc1ccccc1)=CC2c1cc(N)cc(CC(C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 513.766
CB1 binding score: -13.466
InChIKey:JXTNMXPIHVVUJJ-UHFFFAOYSA-N
ID: 82753
SMILES:C1(=O)C(C)CCC2C(C)(C)Oc3cc(CCCC)c(O)c(O)c3C12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -15.367
InChIKey:KYQOVIVYFHNPOB-UHFFFAOYSA-N
ID: 82754
SMILES:C1(C)C(CCC(=CCc2c(O)c(C)cc(OC)c2)C)=C(C)CCC1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -8.194
InChIKey:IKKZNJLGPYHOIO-UHFFFAOYSA-N
ID: 82755
SMILES:Oc1c(CC=C(C)CCC=C(C)C)c(O)c2c(c1CC=C(C)C)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 464.69
CB1 binding score: -15.799
InChIKey:WVRIJPKHYUKGLA-UHFFFAOYSA-N
ID: 82756
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C=C(C)CCC2C1(C)C1C(C=C(C)C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -12.865
InChIKey:OULJQFOECDFVNE-UHFFFAOYSA-N
ID: 82757
SMILES:C1CC(C(C)=C)C(c2c(O)c(O)c(C(C)=CCCC(C)C)cc2O)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -14.856
InChIKey:NQXJQUULHBGCKW-UHFFFAOYSA-N
ID: 82758
SMILES:O=C(OC)c1c(C)cc(O)c(=O)c2c1OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.407
CB1 binding score: -14.923
InChIKey:PRJGCNYSYRIANF-UHFFFAOYSA-N
ID: 82759
SMILES:C1C(C)=CCC2C(C1)C(C)(C)Oc1c(c(O)cc(CCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.171
InChIKey:NQMPUVQVNOMSAX-UHFFFAOYSA-N
ID: 82760
SMILES:C1CC(=O)C2(C)C3(C)C1c1c(cc(CCCCCCC)cc1O3)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -14.763
InChIKey:YKLQYTKQYNPCQE-UHFFFAOYSA-N
ID: 82761
SMILES:C1(c2c(O)cc(CCC)cc2O)C=C(C)C(O)CC1C(O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: -17.917
InChIKey:FKIWDDGKHMFZNR-UHFFFAOYSA-N