ID: 42715
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 42716
SMILES:c12cc(CCCCC)cc(O)c1OC(C)(C)C1OC(C)(CC1)C=C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -12.324
InChIKey:JPBGMLTZZAFOOH-UHFFFAOYSA-N
ID: 42717
SMILES:CC(=CCc1c(C(N)=O)c(O)c2c(c1)OC(C)(C)C1CC(O)C(C)=CC12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Miscellaneous meroterpenoids
MW: 371.477
CB1 binding score: -15.287
InChIKey:MGUOMQKJYHHSLY-UHFFFAOYSA-N
ID: 42718
SMILES:CC(C1CCC(C)=CC1c1c(O)cc(CCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -20.128
InChIKey:YOJPFISTURZHJT-UHFFFAOYSA-N
ID: 42719
SMILES:c1c(C)cc(O)cc1CCC(C)=CCC1C(C)=C[CH]O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 271.38
CB1 binding score: -13.84
InChIKey:LXEXPTGNVGNJBL-UHFFFAOYSA-N
ID: 42720
SMILES:O(C(C)=O)c1c(O)c2c(cc1CCC)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -13.208
InChIKey:OMELDKIYHIQCPS-UHFFFAOYSA-N
ID: 42721
SMILES:C12CC(C)=CC(=O)C(=C(C)C)C1(O)c1c(cc(CCCCC)cc1O)OC2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.472
CB1 binding score: -15.483
InChIKey:IZUIWWAOBFTQOX-UHFFFAOYSA-N
ID: 42722
SMILES:c12c(cc(O)c(CCCCC)c1)OC(C)(C)C1(O)C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -14.172
InChIKey:KEPYQEJPYJNYPF-UHFFFAOYSA-N
ID: 42723
SMILES:C1(C(O)(C)C)C(c2c(O)cc(CCC)cc2O)C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -19.168
InChIKey:BMEOABJGGIYLGA-UHFFFAOYSA-N
ID: 42724
SMILES:C1(=O)C(C)=CC2C(C1)C(C)(C)Oc1c2cc(O)cc1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -16.648
InChIKey:SDGHKHOTBBOBDT-UHFFFAOYSA-N
ID: 42725
SMILES:C1(C)C2C(O)(C(C(=O)C)=C(C)C2O)c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -14.394
InChIKey:SCPREQRTPAVWMO-UHFFFAOYSA-N
ID: 42726
SMILES:OCc1cc(CCCCC)cc2c1-c1c(ccc(C)c1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.464
CB1 binding score: -16.015
InChIKey:AXHHRHHOGUWASJ-UHFFFAOYSA-N
ID: 42727
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1=C2C(C)CC1)CCl
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.833
CB1 binding score: -8.514
InChIKey:CPHXIVXXYXDGOG-UHFFFAOYSA-N
ID: 42728
SMILES:C(C)CCCc1cc2c(c(O)c1)C1C(C(=C)C)CC(O)C(C)=C1CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -16.061
InChIKey:XRVQZPQPEAGARD-UHFFFAOYSA-N
ID: 42729
SMILES:OC(=O)C(=CCc1c(O)cc(CC)c(C2C(C(C)=C)CCC(C)=C2)c1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -16.438
InChIKey:YSGMLTQEZKBZLN-UHFFFAOYSA-N
ID: 42730
SMILES:C1CC(c2c(O)cc(CCCCC)cc2O)(C)C=CC1C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -14.67
InChIKey:AMNWTNPAAHAULW-UHFFFAOYSA-N
ID: 42731
SMILES:c1c2c(cc(C(=O)C=C(CCC=C(C)C=O)C)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.539
CB1 binding score: -17.792
InChIKey:UDEBZVXGHYOQHP-UHFFFAOYSA-N
ID: 42732
SMILES:CC1(C)C2C(c3c(cc(CCCCC)cc3O)O1)CC(CO)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.233
InChIKey:LXSFNMQURHTPIT-UHFFFAOYSA-N
ID: 42733
SMILES:C1(C)(C)Oc2c(c(O)cc(C)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -20.957
InChIKey:WIDIPARNVYRVNW-UHFFFAOYSA-N
ID: 42734
SMILES:Oc1cc(CCCC)cc2c1OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -16.879
InChIKey:IXZUQKJFDLWXNQ-UHFFFAOYSA-N
ID: 42735
SMILES:C(c1c(O)c2cc(C)ccc2c(C2C(C(C)=C)CCC(C)=C2)c1)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 322.448
CB1 binding score: -15.12
InChIKey:YNOQDJZFAROVEH-UHFFFAOYSA-N