ID: 45613
SMILES:C(C)Cc1cc(O)c(C2C=C(CO)CCC2C(C)(O)C)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -15.668
InChIKey:HMICNQSSLJQOOU-UHFFFAOYSA-N
ID: 45614
SMILES:C1CC2C=C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.703
InChIKey:SBCRKZZPPZZDFD-UHFFFAOYSA-N
ID: 45615
SMILES:C(CC)Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 45616
SMILES:C(c1c2c3c(cc1O)OC1(C)CC3C(CC1)C(C)(C)O2)(CC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -15.83
InChIKey:PDCRGUDRMIGBSK-UHFFFAOYSA-N
ID: 45617
SMILES:C1(C)CCC=C(C)C2C(CC1)C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -12.377
InChIKey:DQMMUZVTRXSWDY-UHFFFAOYSA-N
ID: 45618
SMILES:C(C(C)C)(=O)c1c2c(c(O)c(CC=C(C)C)c1O)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -16.387
InChIKey:KWQGHCURZLWPOU-UHFFFAOYSA-N
ID: 45619
SMILES:C1C(C(C)C)C2c3c(c(C(=O)O)c(CCCCC)cc3O)OC(C)(C1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -16.182
InChIKey:ATMVOFFJZCPIPO-UHFFFAOYSA-N
ID: 45620
SMILES:C(CCC)Cc1c(O)c2c(c(C=O)c1O)OC(C)(C)C1CCC(C(=O)O)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.46
CB1 binding score: -13.113
InChIKey:TVCDRFPTSXMEAI-UHFFFAOYSA-N
ID: 45621
SMILES:c1c(OCCC(C)C)c(C2C=C(C)CCC2C(=C)C)c(OC)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -15.187
InChIKey:OUULEYFLIXWEOC-UHFFFAOYSA-N
ID: 45622
SMILES:C(Cc1cc(O)c2c(c1C(C)C)OC(C)(C)C1CC=C(C)CC21)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -15.552
InChIKey:KYTHROKIOIZFPF-UHFFFAOYSA-N
ID: 45623
SMILES:C1c2c(O)c(C(OC)=O)c(CCCCC)c(O)c2C2C3(CO)C1OC(C)(C)C3CCC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.584
CB1 binding score: -17.912
InChIKey:ODSMVECXBCWYNA-UHFFFAOYSA-N
ID: 45624
SMILES:CCCCCc1cc2c(c(O)c1)C1C(CC(C)(C)O1)C(C)(O)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -16.171
InChIKey:IYBUBYYXOFIMIK-UHFFFAOYSA-N
ID: 45625
SMILES:CC12OC(=O)C(=CC)C3(C(C(C)=C)CC1)Oc1c(c(O)cc(CCCCC)c13)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.527
CB1 binding score: -13.428
InChIKey:ISNPXZQPUHHTBN-UHFFFAOYSA-N
ID: 45626
SMILES:Oc1cc2c3c(c1)OC(c1c(O)cc(CCCCC)cc1OC(=O)C)C(C#C)C3C(C)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.532
CB1 binding score: -15.29
InChIKey:KZMMLYDNTFYHJH-UHFFFAOYSA-N
ID: 45627
SMILES:C(CCCCc1cc2c(c(O)c1)C1CC(C)=CCC1C(C)(C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -20.649
InChIKey:ZHYPKENABBMAAN-UHFFFAOYSA-N
ID: 45628
SMILES:c1(O)cc(CCCCC)ccc1C(CC)(C)C
Pathway: Polyketides
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 234.383
CB1 binding score: -16.419
InChIKey:RPTPXODNYNRJLC-UHFFFAOYSA-N
ID: 45629
SMILES:C12=C(c3c(cc(CCCCC)cc3O)OC1(C)C)C=C(CO)CC(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -13.01
InChIKey:OKODEEIFVQOCEQ-UHFFFAOYSA-N
ID: 45630
SMILES:c12c(C(=O)O)cc(CCCCC)cc1OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -17.181
InChIKey:WWIXNHQGWWBRDI-UHFFFAOYSA-N
ID: 45631
SMILES:c1(CCCC)cc2c(cc1O)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -16.866
InChIKey:GRKLGEKOVABPPB-UHFFFAOYSA-N
ID: 45632
SMILES:C1(C)(C)C2C(C)(CC3(O)Oc4c(c(OC)cc(CCCCC)c4)C23)CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -16.502
InChIKey:WSTWWMWLXCOWSY-UHFFFAOYSA-N
ID: 45633
SMILES:C1(C)(C)C2C(=O)C=C(C)CC2c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -18.035
InChIKey:KEAXRVVDSBXMMT-UHFFFAOYSA-N