ID: 62812
SMILES:O(C(=O)C)Cc1c(CCCCC)cc2c(c1O)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -16.847
InChIKey:MVRVNPVQJPSPTF-UHFFFAOYSA-N
ID: 62813
SMILES:O=C1C(=C(C)C)C2c3c(cc(CCCCC)cc3O)OC(C)(C(=O)C1)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -15.847
InChIKey:WDKNSCRPTCQBBH-UHFFFAOYSA-N
ID: 62814
SMILES:C(C1C(=O)C2(Oc3cc(CCCCC)ccc32)C2C=C(CCC(=C(CO)C)C1O)C(=O)O2)OC(C=CCCCCC)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 580.718
CB1 binding score: -16.052
InChIKey:FPEVKPVEBMXXPA-UHFFFAOYSA-N
ID: 62815
SMILES:Oc1c2c(cc(CCCCC)c1)C1C(CC(C)(C)O1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -16.065
InChIKey:FTKMVJRZBRQLMD-UHFFFAOYSA-N
ID: 62816
SMILES:CC1=CC(c2c(O)cc(CCCCCO)cc2OC)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -18.957
InChIKey:UJYIVYWDQFGCJM-UHFFFAOYSA-N
ID: 62817
SMILES:CC(CCC=C(C)C)CCCC(=CCc1c(O)c(C)cc(O)c1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -19.162
InChIKey:GVVUQQWWMGBFAL-UHFFFAOYSA-N
ID: 62818
SMILES:C1C(C)(O)C2C(C)(CCC3C(C)(C)Oc4c(c(O)c(C(CCCCC)=O)c(CCCCC)c42)C3)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 498.748
CB1 binding score: -14.435
InChIKey:GCOZLOUCEQMEDR-UHFFFAOYSA-N
ID: 62819
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 62820
SMILES:C(CC)CCc1ccc2c(c1O)OC1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.039
InChIKey:SWXQMIIAYGJEDG-UHFFFAOYSA-N
ID: 62821
SMILES:C1C(C)(C)Oc2cc(CCCCC)c(C(=O)O)c(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.348
CB1 binding score: -18.13
InChIKey:BQOIKHJQWFSXOS-UHFFFAOYSA-N
ID: 62822
SMILES:c1(CCC)c(C)c2c(c(O)c1)C1C=C(CCC=C(CCC=C(C(=O)O)C)C)C(O)CC1C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.608
CB1 binding score: -12.435
InChIKey:FFJNDLQJPROHKY-UHFFFAOYSA-N
ID: 62823
SMILES:Oc1c(CC=C(C)CCC=C(C)C)cc(CCCC)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 286.459
CB1 binding score: -18.208
InChIKey:PSMHNXSQELAMNN-UHFFFAOYSA-N
ID: 62824
SMILES:C(CCc1cc(O)c(C2C=C(C)CCC2C(=C)C)cc1O)=C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.599
CB1 binding score: -16.62
InChIKey:PEQYTUSUVURSFA-UHFFFAOYSA-N
ID: 62825
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(C(=O)O)(CCC(C)(CCC=C(C)CCC=C(C)C)O1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.65
CB1 binding score: -13.99
InChIKey:WKKMPWPYZVDRQM-UHFFFAOYSA-N
ID: 62826
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C1C2C(O)C(C)(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -19.298
InChIKey:TZGCTXUTNDNTTE-UHFFFAOYSA-N
ID: 62827
SMILES:C1=C(C)CCC(C(=C)C)C1c1c(O)cc(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N
ID: 62828
SMILES:CCCCCCCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -18.687
InChIKey:RGXKCMQANRHRCO-UHFFFAOYSA-N
ID: 62829
SMILES:C1(C)(C)C(C)=C2C(=O)C3=C4C12c1c(cc(CCC)cc1O)OC3C1CN(C2OC(C)(C)C1CC2)OC4O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 507.627
CB1 binding score: -13.748
InChIKey:ZQKMKXKZMCKMBJ-UHFFFAOYSA-N
ID: 62830
SMILES:C(CCCC)Cc1cc2c(c(O)c1)C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -20.649
InChIKey:ZHYPKENABBMAAN-UHFFFAOYSA-N
ID: 62831
SMILES:C(O)C(C)=CCCC(C)=CCc1c(O)c(CC=C(C)C)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.846
InChIKey:XCFMIWIAGQOTGF-UHFFFAOYSA-N
ID: 62832
SMILES:C(CCC)c1cc(O)c(C2C(C(C)C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -18.479
InChIKey:QHFVULIOBFWRAD-UHFFFAOYSA-N