ID: 39943
SMILES:c1(O)c2c(c(CC=C(O)CO)cc1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: Not available
InChIKey:CKMJAVKTBLCSIL-UHFFFAOYSA-N
ID: 39944
SMILES:CCCCCCc1cc2c(c(O)c1)C1CC(CO)(C)C3C1C(CCC3C)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.63
CB1 binding score: -14.562
InChIKey:AWZONDRDNWWNBH-UHFFFAOYSA-N
ID: 39945
SMILES:c1(CCCCC)ccc2c(c1)OC(C)(C)C1C2CC(=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -17.687
InChIKey:FAILRRYKWGYKKV-UHFFFAOYSA-N
ID: 39946
SMILES:O=C(C)c1c2ccc(CC)cc2c2c(c1O)OC1C3C(C(C)C)CCC(C)C32c2c(O)cc(CCCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 542.716
CB1 binding score: -13.864
InChIKey:YRIGYGYKJPTVRA-UHFFFAOYSA-N
ID: 39947
SMILES:CC1CC2C(C(C)(C)Oc3c2c(O)cc(CCC)c3)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -17.842
InChIKey:LYHDJNVGCYSLDO-UHFFFAOYSA-N
ID: 39948
SMILES:C(CC(=O)OCc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(CCC=C(C)C)C(=O)C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.553
CB1 binding score: -13.401
InChIKey:STQDJDKBXRGDSA-UHFFFAOYSA-N
ID: 39949
SMILES:C1(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 39950
SMILES:C1C(C)=CC2C(C1)C(C)(C)Oc1cc(C)c(C(O)C(=CC)C)c(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -17.845
InChIKey:SKJOEAYUKUTZKP-UHFFFAOYSA-N
ID: 39951
SMILES:C1(C)(C)Oc2c(c(O)cc(CCC)c2)C2C1CCC(CO)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.9
InChIKey:UWBCYGUAEGZJRC-UHFFFAOYSA-N
ID: 39952
SMILES:c1(CCC)cc(C2C(C(=C)C)CCC(C)=C2)c(O)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 270.416
CB1 binding score: -16.449
InChIKey:LKADTOARHRWCAE-UHFFFAOYSA-N
ID: 39953
SMILES:CC1(C)Oc2cc(CCCCC)ccc2C2C1CC(O)C(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.229
InChIKey:WPXCENVWOMHAGF-UHFFFAOYSA-N
ID: 39954
SMILES:c1(CC2C(CCC=C(C)C)C(C=O)=C(C)C2)cc(O)c(CC=C(C)C)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -15.674
InChIKey:PMCYJVHRZXBCBJ-UHFFFAOYSA-N
ID: 39955
SMILES:C1C2C(c3c(cc(CCCC)cc3O)O1)C(=O)OCC2COC1C(O)C(O)C(O)C(CO)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.499
CB1 binding score: -15.539
InChIKey:STHPZFXIWWCVFJ-UHFFFAOYSA-N
ID: 39956
SMILES:C1(c2c(O)cc(CCCCC)cc2O)OC(=O)C(C)=CCCC(=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.547
InChIKey:IVVNRRRTBOXWMO-UHFFFAOYSA-N
ID: 39957
SMILES:C(=O)(C)c1c(O)c2c(cc1C)OC(C)(C)C1CCC(C(=O)O)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.38
CB1 binding score: -13.953
InChIKey:DHKCNHYKPHLZQT-UHFFFAOYSA-N
ID: 39958
SMILES:c1(C)c2c(c(N)c(C=NCC#N)c1)OC(CC=C(C)CCC=C(C)C)(C)C(Cl)=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 411.977
CB1 binding score: -14.37
InChIKey:MWHWWSJAJHCVGT-UHFFFAOYSA-N
ID: 39959
SMILES:C12C(C)CCC1C(C)(C)Oc1c(c(OC)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -16.187
InChIKey:XOJHTPVRBURKQH-UHFFFAOYSA-N
ID: 39960
SMILES:C1CC2(C(C)C)Oc3c(c(O)cc(CCCCC)c3)C2C1(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -16.502
InChIKey:GPBXWFMAMMNXCL-UHFFFAOYSA-N
ID: 39961
SMILES:C(CCCCC)Cc1cc(O)c2c(c1)OC(C)(C)C1C2CC(O)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -13.781
InChIKey:BHRPXIDAVKSFEQ-UHFFFAOYSA-N
ID: 39962
SMILES:C1(C(C)=C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 39963
SMILES:c12c(c(CCCCC)cc(O)c1O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.585
InChIKey:HSSWXEGGDNCSBM-UHFFFAOYSA-N