ID: 60292
SMILES:C1(C)=CC(c2c(OCC)cc(CCCCC)c(O)c2)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -15.592
InChIKey:SDHCDPXTBBHSPQ-UHFFFAOYSA-N
ID: 60293
SMILES:C12(C)C(C(OC(=O)C(CC)C)C3C(=C)C(=O)OC3C1)c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.552
CB1 binding score: -16.502
InChIKey:XKXDZVIMAONOIJ-UHFFFAOYSA-N
ID: 60294
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(C(O)(C)C)CCC(=C)C1C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -14.605
InChIKey:ZTYDBSGEBGZPEG-UHFFFAOYSA-N
ID: 60295
SMILES:c1c2c(cc(CCCCC)c1)OC(C)(C)C1=C2C2=C(C(=O)C(OC)=CC2=O)CC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 420.549
CB1 binding score: -14.309
InChIKey:CUMVYAXBHYMNEX-UHFFFAOYSA-N
ID: 60296
SMILES:C(C(=O)C)c1cc(O)c2c(c1)OC(C)(C)C1C2C=C(COC(C)=O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.434
CB1 binding score: -14.846
InChIKey:JURDMMNAZILXGZ-UHFFFAOYSA-N
ID: 60297
SMILES:CC1=CC(c2ccc(CCCCC)cc2)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.471
CB1 binding score: -19.804
InChIKey:VGBLUPCGCQUYRW-UHFFFAOYSA-N
ID: 60298
SMILES:CC1=CC2c3c(O)cc(CCCCC)cc3OC(CCC2(O)C)C(C)(C)CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -16.37
InChIKey:ZZANOHSGDCDZSS-UHFFFAOYSA-N
ID: 60299
SMILES:CC(=CCc1c(CC=C)cc(O)cc1C(C)C(CCC(C)(C)O)=O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.636
InChIKey:IODUGKLGMVLBGX-UHFFFAOYSA-N
ID: 60300
SMILES:Oc1cc(CCCCC)cc2c1C1C=C(C(=O)OC)C3C4C(C)(C)C4CCC(=C)C3OC21C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.619
CB1 binding score: -16.964
InChIKey:KDESJCDBTSFGBF-UHFFFAOYSA-N
ID: 60301
SMILES:BrC1CC2C3(c4c(O)cc(CCCCC)cc4O1)C2C(C)(C)CCC3=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 421.375
CB1 binding score: -12.898
InChIKey:RVAPHSYGIWOEDH-UHFFFAOYSA-N
ID: 60302
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)(O)C(Br)C1)(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 383.282
CB1 binding score: -15.513
InChIKey:WPOHDJJQXQONLC-UHFFFAOYSA-N
ID: 60303
SMILES:c1(CC=C(C)CCC=C(CCC=C(C)C)C)cc(O)c(CC(=O)O)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Merosesquiterpenoids;Tetraketide meroterpenoids
MW: 372.505
CB1 binding score: -18.306
InChIKey:BDRGSNYWOXCBFU-UHFFFAOYSA-N
ID: 60304
SMILES:CC1=CC(c2c(OC)ccc(CCN(C)C)c2)C(C(C)=C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 313.485
CB1 binding score: -18.294
InChIKey:GJDVDGGMUGCJGX-UHFFFAOYSA-N
ID: 60305
SMILES:C12C(=CC3C=C(C)C(=O)O3)C(C)(CCCC(C)=C1)Oc1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.564
CB1 binding score: -11.836
InChIKey:RFMATMVYOWLKPX-UHFFFAOYSA-N
ID: 60306
SMILES:c12c(c(O)cc(CCCCC)c1)OC(CCC=C(C)C)(C)C2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -16.943
InChIKey:PEQNLUAQVXFCKP-UHFFFAOYSA-N
ID: 60307
SMILES:C12=C(c3c(cc(C)cc3O)OC1(C)C)CC(C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -16.691
InChIKey:MIFGVBFXDBKVID-UHFFFAOYSA-N
ID: 60308
SMILES:O1C2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1C(C)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -14.869
InChIKey:DKKDOZXPWFSKEK-UHFFFAOYSA-N
ID: 60309
SMILES:Oc1c(CC=C(C)CCC=C(C)C)cc(O)cc1CC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.748
InChIKey:VRXKPPYOGGSRFK-UHFFFAOYSA-N
ID: 60310
SMILES:C1CC(C)=CCC12C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.228
InChIKey:XQYSGOVDVJLJAU-UHFFFAOYSA-N
ID: 60311
SMILES:C(CC)CCCc1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -18.609
InChIKey:HAKUWGCTBUVNJQ-UHFFFAOYSA-N
ID: 60312
SMILES:c1(O)c(CCC(C(O)CC=C(C)C)C)cc(O)cc1CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -14.98
InChIKey:ANKFPPCVBBBACW-UHFFFAOYSA-N