ID: 83056
SMILES:c1cc(O)cc2c1OC(C)(C)C1CCC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -20.067
InChIKey:OBJJEVJNCDBGOD-UHFFFAOYSA-N
ID: 83057
SMILES:CC(CCC=C(C)C)=CCCC(=CCc1c(O)cc(CCc2ccccc2)cc1O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.621
CB1 binding score: -19.13
InChIKey:IWSASXREQYAISF-UHFFFAOYSA-N
ID: 83058
SMILES:Oc1cc(CC=C(C)C)c(O)c(CC=C(C)CCC=C(C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.748
InChIKey:VRXKPPYOGGSRFK-UHFFFAOYSA-N
ID: 83059
SMILES:O(C(=O)c1c(-c2c(O)cc(CCCCCC)cc2O)cc(O)c2c1OC(C)(C)C(O)C2)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.524
CB1 binding score: -17.48
InChIKey:MBCMUZINJZGIEV-UHFFFAOYSA-N
ID: 83060
SMILES:CCCCCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)(O)C(O)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.482
CB1 binding score: -16.783
InChIKey:JNZOVPMTOQVFAH-UHFFFAOYSA-N
ID: 83061
SMILES:C1C=C(C(C)C)C(c2c(O)cc(CCCCC)cc2OC(=O)C)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -17.475
InChIKey:XVEAPSNGBUNGER-UHFFFAOYSA-N
ID: 83062
SMILES:C1(C)(C)Oc2c(c(O)cc(CCC)c2)C2CC(O)(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -19.509
InChIKey:XAJXLANJASZEBB-UHFFFAOYSA-N
ID: 83063
SMILES:C(OC(C(O)c1cc(O)c(O)cc1)=O)c1c2c(c3c(c1)OC(C)(C)C1C3C=C(C)CC1)COC2=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.513
CB1 binding score: -14.823
InChIKey:MHWWJNCEOPFUMJ-UHFFFAOYSA-N
ID: 83064
SMILES:C1CC2C(C)(C)Oc3cc(CCCC)cc(O)c3C12C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -16.367
InChIKey:XZCUVNSTBHMGSS-UHFFFAOYSA-N
ID: 83065
SMILES:C1(C)CCCC(C)(C(O)=O)CC1=Cc1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -16.094
InChIKey:CSPGPKZZDYSZOV-UHFFFAOYSA-N
ID: 83066
SMILES:O(C(CO)C(C)(C)O)c1c(O)c2c(cc1C)OC(C)(C)C1C2CC(C)(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.508
CB1 binding score: -13.87
InChIKey:MRXRJEPNTKAFKT-UHFFFAOYSA-N
ID: 83067
SMILES:c1(CCC)c2c(ccc1O)OC(C)(CCC=C(C)C)C=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -15.519
InChIKey:PIQSIUWHDFHXKX-UHFFFAOYSA-N
ID: 83068
SMILES:C(C(C)=CCc1c(O)cc(CCC(C)C)c(O)c1)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.61
InChIKey:JUKGOJLUTGVING-UHFFFAOYSA-N
ID: 83069
SMILES:c12c3c(cc(C)c1C(=O)C(=O)C(C)=C2)OC(C)(C)C1C3C=C(C)CC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.458
CB1 binding score: -15.501
InChIKey:NRJRFXBDSBAYJP-UHFFFAOYSA-N
ID: 83070
SMILES:c1(-c2ccccc2O)cc(O)c2c(c1)OC(C)(C)C1C2C=C(CSC(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.579
CB1 binding score: -14.044
InChIKey:QEKMKXVEDXKESP-UHFFFAOYSA-N
ID: 83071
SMILES:C12CC(C)C(=O)CC3C1=C(C(C)(C)Oc1c3c(C)cc(O)c1O2)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.408
CB1 binding score: -14.847
InChIKey:BORPKLNMHFKPLQ-UHFFFAOYSA-N
ID: 83072
SMILES:C1C(C)(C)C2C(C)(CC1)Oc1c(O)cc(CCCCC)cc1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.298
InChIKey:BXDONIIVZXTLCN-UHFFFAOYSA-N
ID: 83073
SMILES:C1(C(C)=C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 83074
SMILES:C(C)CCCCc1cc(O)c2c(c1O)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.327
InChIKey:KCHDGNWQYWLSBR-UHFFFAOYSA-N
ID: 83075
SMILES:O=C(C=C(C)C)Cc1cc2c(c(O)c1)C1CC(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.512
InChIKey:HNRIOWYAFKTYSF-UHFFFAOYSA-N
ID: 83076
SMILES:C1Cc2c(C)cccc2C2C(c3c(cc(CCCCC)cc3OC)OC2)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.529
CB1 binding score: -10.497
InChIKey:SGQUFRBPTKJJOB-UHFFFAOYSA-N