ID: 13714
SMILES:CC(C)C1C(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: 13715
SMILES:C(CCc1cc2c(c(O)c1)C1CC(C)=CCC1C(C)(C)O2)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 13716
SMILES:O1C(C)(CC=CC(OO)(C)C)C2C(C)(C1)C=Cc1c(O)cc(CCCCC)cc1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -15.288
InChIKey:DDFHTUKTDWXYQC-UHFFFAOYSA-N
ID: 13717
SMILES:C(OC(C(C)c1c2c(c(CCCCCC)cc1O)OC(C)(C)C1CCC(C)=CC12)=O)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.667
CB1 binding score: -15.465
InChIKey:PNVNJBWVIGTGEG-UHFFFAOYSA-N
ID: 13718
SMILES:C(C1=CC2c3c(cc(C)cc3O)OC(C)(C)C2CC1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -17.214
InChIKey:ASRCITNWYBEUHX-UHFFFAOYSA-N
ID: 13719
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(C(O)(C)CCC1C(C)=C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.142
InChIKey:RBEAVAMWZAJWOI-UHFFFAOYSA-N
ID: 13720
SMILES:CC(=CCCC(C)=CCc1c(O)cc(CCc2ccccc2)cc1O)CC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.529
CB1 binding score: -14.738
InChIKey:SJHIQMMFHICMIH-UHFFFAOYSA-N
ID: 13721
SMILES:C(CCCCC)Cc1cc2c(c(O)c1)C1CC(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.539
CB1 binding score: -17.402
InChIKey:USZILQYXSONCHH-UHFFFAOYSA-N
ID: 13722
SMILES:C(CCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)(O)C1O)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.564
CB1 binding score: -15.163
InChIKey:QFIALAWXAJLKKM-UHFFFAOYSA-N
ID: 13723
SMILES:Oc1cc(CCCC)cc2c1C1C(CC=C(C)C2)C(C)(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -16.19
InChIKey:BSVOFPMHHUOJID-UHFFFAOYSA-N
ID: 13724
SMILES:C(=CC(=C)C)CC(=CCc1cc(O)cc(C)c1O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.746
InChIKey:SAVHMKMRPFLBRI-UHFFFAOYSA-N
ID: 13725
SMILES:CC12C3C(C(C(OC)=O)=CCC3)C(c3c(O)cc(CCCCCC)cc3OC(C)=O)OC1OCC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 486.605
CB1 binding score: -14.452
InChIKey:RYMSGEPBTUWTQI-UHFFFAOYSA-N
ID: 13726
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1CC=C(CO)C(=O)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.778
InChIKey:UQPUAGROCZMHSP-UHFFFAOYSA-N
ID: 13727
SMILES:C(C(C)=CCC(=O)C(=CCc1c(O)cc(CCCCC)cc1O)O)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -14.625
InChIKey:XHSKHBFCUSVWIV-UHFFFAOYSA-N
ID: 13728
SMILES:C(C)(C1=CC(=O)C2(C)Oc3c(c(O)cc(CCCCCC)c3)C2C1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -16.015
InChIKey:QIOICLVHAAGTCO-UHFFFAOYSA-N
ID: 13729
SMILES:C1C(CC=C(CCC=C(C)C)C)(C)Oc2c(c(O)cc(CCCCC)c2)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -15.415
InChIKey:DOWFXPUSJXIQQX-UHFFFAOYSA-N
ID: 13730
SMILES:C12c3c(cc(CCCCC)cc3O)OC(C(O)(C)C)CCC1CO2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -13.323
InChIKey:AWQXANVPRKDSET-UHFFFAOYSA-N
ID: 13731
SMILES:O1c2c(c(O)c(C(=O)C=CC(O)(C)C)c(CCCCC)c2)C=CC1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.502
InChIKey:SJZZCKMBKIYJAN-UHFFFAOYSA-N
ID: 13732
SMILES:C1C2c3c(cc(CCCCC)cc3O)OC(C)(C)C3C2C(C(O)(C)C1)C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -12.954
InChIKey:UCGFCCYOLXTJIU-UHFFFAOYSA-N
ID: 13733
SMILES:C1C(C)C(Cc2c(O)cc(CCCCC)cc2O)(C)C2CCC(C)=CC2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -14.55
InChIKey:VREZSMHJSXKYFO-UHFFFAOYSA-N
ID: 13734
SMILES:C(CCC)CCCCCCCCCCCC(c1c(O)cc2c(c1)OC(C)(C)C1C2C=C(C)CC1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 482.749
CB1 binding score: -16.903
InChIKey:FTILRPBJBNCIMC-UHFFFAOYSA-N