ID: 83497
SMILES:CC1(C)Oc2c(c(O)cc(CCCCCCO)c2)C2CC1CCC2(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -15.817
InChIKey:JVKQQTPNHKDWQP-UHFFFAOYSA-N
ID: 83498
SMILES:C1(C)CCC(C(C)C)C(c2c(O)cc(CCCCC)cc2OC)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.527
CB1 binding score: -15.548
InChIKey:QQQKZJHZMHFSOL-UHFFFAOYSA-N
ID: 83499
SMILES:C(C)(C1=CC(=O)C2=C(C13OC3CCC(C)(C)O2)C)OO
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 280.32
CB1 binding score: Not available
InChIKey:UYMQSJLWIZNBBV-UHFFFAOYSA-N
ID: 83500
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1C2C(CC(C)O)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -12.867
InChIKey:SEQQGTDRMHSMDO-UHFFFAOYSA-N
ID: 83501
SMILES:Oc1c2c(cc(CCCCC)c1-c1c(C)c3c(c(C(C)C)c(O)c(O)c3C=O)cc1C)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 570.77
CB1 binding score: -14.494
InChIKey:YZYXQFLBQJQRJG-UHFFFAOYSA-N
ID: 83502
SMILES:C(C=C(C)CCC=C(C)C)CC(=CCc1c(O)cc(CCCCC)c(C(=O)O)c1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 428.613
CB1 binding score: -18.353
InChIKey:QNRJPRFPLQBROG-UHFFFAOYSA-N
ID: 83503
SMILES:CCCCCc1cc2c(c(O)c1)C1OC3(CCCC(C)(C)C3C1)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.678
InChIKey:JBNMGEMFGLCEMO-UHFFFAOYSA-N
ID: 83504
SMILES:c1cc(CCCC)c(O)c2c1OC(CCC=C(C)C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -16.751
InChIKey:VTQUXGAPYAWVKW-UHFFFAOYSA-N
ID: 83505
SMILES:CC1(C)C2(CCC(=CBr)C(=O)O2)c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 409.32
CB1 binding score: -14.69
InChIKey:AXEXCRYFWZAQAG-UHFFFAOYSA-N
ID: 83506
SMILES:O=C(CC)c1cc2c(c(O)c1)C1CC(C)(OC)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -11.791
InChIKey:QKRRXTNQEZUCJP-UHFFFAOYSA-N
ID: 83507
SMILES:C1(C)=CCCC(=C)C2C(CC1)C(C)(C)Oc1c2cccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.427
CB1 binding score: -17.454
InChIKey:JOIGAAUCVYUZTJ-UHFFFAOYSA-N
ID: 83508
SMILES:Oc1c(O)cc2c(c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -18.748
InChIKey:UESOFUAUNDLWRH-UHFFFAOYSA-N
ID: 83509
SMILES:O(c1cc(OC)c2c(c1C)OC(C)(C)C1CCC(C)=CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.09
InChIKey:WFJOQMJIFJZLDH-UHFFFAOYSA-N
ID: 83510
SMILES:CC(=CCCC(C)=CCCC1(C)Oc2c3c(cc(C)c2)OC(C)(C)C2C3C=C(COC(=O)c3c(C)cc(O)cc3O)CC21)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 600.796
CB1 binding score: -16.453
InChIKey:BSIPBTQBIRRNLL-UHFFFAOYSA-N
ID: 83511
SMILES:C(CCC(C)=CCOc1c2c(cc(O)c1Cc1cc(O)ccc1)OC(C)(C)C1CCC(C)(O)CC21)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 534.737
CB1 binding score: -16.212
InChIKey:LVJUQGPNUZTZTM-UHFFFAOYSA-N
ID: 83512
SMILES:C(Cc1cc(O)c(C2C(C(CC(C=C(C)C)=O)C)C(O)CC(C)=C2)c(O)c1)OC(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.541
CB1 binding score: -15.378
InChIKey:WNDBUGLLTFHECC-UHFFFAOYSA-N
ID: 83513
SMILES:C12CCC(=C)C(O)CC13C(=C(C)C)Oc1c(c(OC)cc(CCCCCC)c1)C32
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -13.495
InChIKey:RFDKPMOPMXAOLU-UHFFFAOYSA-N
ID: 83514
SMILES:C1(=C(C)C)CCC(C)CC1c1c(O)cc(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -16.502
InChIKey:VNCXGKGIYNEMMW-UHFFFAOYSA-N
ID: 83515
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C(CC=C(C)C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.824
InChIKey:INTNPSTYODPHGD-UHFFFAOYSA-N
ID: 83516
SMILES:C1(C(C)=C)CC=C(C)CC1c1c(O)cc(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -18.748
InChIKey:ORIYPICUSOGUOA-UHFFFAOYSA-N
ID: 83517
SMILES:O(c1c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(CO)=CC12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -18.153
InChIKey:FHFWMWLGGRCLAF-UHFFFAOYSA-N