ID: 27931
SMILES:C(C)(C)CC(c1cc(O)c2c(c1)C1C=C(CO)CCC1C(C)(C)O2)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.039
InChIKey:AGIRNSNOSJEOAF-UHFFFAOYSA-N
ID: 27932
SMILES:c1(O)cc(CCCCC)cc2c1OC1(CCC(C(C)(C)O)O1)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: -13.323
InChIKey:RKXBPUYAMLLQTO-UHFFFAOYSA-N
ID: 27933
SMILES:c1(CCC)cc2c(c(O)c1)C1CC(C)=CCC1=C(C)C2=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.383
CB1 binding score: -15.336
InChIKey:RNHCFRZPNAJCKP-UHFFFAOYSA-N
ID: 27934
SMILES:Oc1c(C=O)c(O)c(C=O)c2c1C1C(C(C)(C)O2)CC=C(CCC(O)C(C)=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.471
CB1 binding score: -16.036
InChIKey:UCJAFXGSPXPHFP-UHFFFAOYSA-N
ID: 27935
SMILES:C(CCc1cc2c(c(O)c1)C=CC(CCC=C(C)C)(C)O2)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -15.618
InChIKey:KUYVRXAQBCAHEN-UHFFFAOYSA-N
ID: 27936
SMILES:c1c(O)c2c(c(CC=C(C)C)c1C(=CC)C)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.545
CB1 binding score: -16.438
InChIKey:IDIJGHZLGHPNQF-UHFFFAOYSA-N
ID: 27937
SMILES:Oc1c2c(c(C(C(CC)C)=O)c(O)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.453
InChIKey:NIZQVFOBIVYVBJ-UHFFFAOYSA-N
ID: 27938
SMILES:C1C(C)=CC2OC(C)(C)C(O)C(OC(C)=O)CC(C)=CC2c2c(c(C(OC)=O)c(C)cc2O)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 474.55
CB1 binding score: Not available
InChIKey:RCDXTLPXMNYKOX-UHFFFAOYSA-N
ID: 27939
SMILES:C1(OC)CCC2(O)C3C(c4c(cc(CCCCC)cc4OC)OC3)CCC12C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -16.693
InChIKey:MBDAEVIUGSVEAQ-UHFFFAOYSA-N
ID: 27940
SMILES:O=C(c1cc2c(c(O)c1)C1C(CCC(CO)=C1)C(C)(C)O2)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.342
CB1 binding score: -18.674
InChIKey:FPTJZRPHZMUVEY-UHFFFAOYSA-N
ID: 27941
SMILES:Cc1c(-c2c(C)cc(O)c(C(C)CCC=C(C)C)c2)c(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 474.685
CB1 binding score: -12.157
InChIKey:LPIBCTCOGFPOJL-UHFFFAOYSA-N
ID: 27942
SMILES:O=C(C=C(C)C)CC(=CC1c2c(cc(CCC)cc2O)OC1(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 342.479
CB1 binding score: -16.52
InChIKey:AJPWFRRPPMNFIC-UHFFFAOYSA-N
ID: 27943
SMILES:c1(CCCCC)cc2c(c(O)c1)OC(C)(CCC=C(C)C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.581
InChIKey:WTPLHNOHHJDOPW-UHFFFAOYSA-N
ID: 27944
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: 27945
SMILES:CC1=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 27946
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C(C(O)(C)C)CCC(OC3OC(CO)C(O)C(O)C3O)(C)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 510.624
CB1 binding score: -14.744
InChIKey:WNGTYGPKKQNQCP-UHFFFAOYSA-N
ID: 27947
SMILES:C(Cc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1)Cc1ccc(O)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.511
CB1 binding score: -16.259
InChIKey:DQONAJRNMLPVNQ-UHFFFAOYSA-N
ID: 27948
SMILES:c12c(cc(Cl)c(O)c1)OC(C)(C)C1C2C(C(O)=O)CCC1C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.858
CB1 binding score: -15.077
InChIKey:IKUDCPCWFXHHLR-UHFFFAOYSA-N
ID: 27949
SMILES:c1(O)cc(CCCC)cc2ccc3c(c12)OC(C)(CCC=C(C)CCC=C(C)C)C=C3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.621
CB1 binding score: -15.43
InChIKey:LAXRACMHDLIDCP-UHFFFAOYSA-N
ID: 27950
SMILES:c1(C2C3C(C)=CC(C=C(CCC(C(=CCC=C(C)C)C)C)O3)CC2)c(O)c(C)cc(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.636
CB1 binding score: -16.249
InChIKey:OVXOIWFFAKSICT-UHFFFAOYSA-N
ID: 27951
SMILES:O1C2(C)C1C1CC(C)(C)C=C3C1C(c1c(O)cc(CCCCC)c(O)c13)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -14.254
InChIKey:RPUQLGSJYOLRSQ-UHFFFAOYSA-N