ID: 61384
SMILES:c1(C(=C(C)C(OC)=O)O)cc(OC)c2c(c1C)C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -15.349
InChIKey:IDBKUEKUPBQSJU-UHFFFAOYSA-N
ID: 61385
SMILES:CNCc1c2c(cc(O)c1)C=CC(C)(CCC=C(C)C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 287.403
CB1 binding score: -16.733
InChIKey:UZFICGWURVIAQN-UHFFFAOYSA-N
ID: 61386
SMILES:c1(CCCC(C)CC(=O)CCCCCCCCCC)cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 496.776
CB1 binding score: -12.923
InChIKey:DSIIQSREFANNKO-UHFFFAOYSA-N
ID: 61387
SMILES:c1(OC(Cc2ccc(OC)cc2)=O)cc2c(cc1C)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.522
CB1 binding score: -14.454
InChIKey:RMRZLAXJVXAWCC-UHFFFAOYSA-N
ID: 61388
SMILES:C1c2c(cc(CCCCC)cc2O)OC(C)(C)C1=CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.29
InChIKey:KVBDMZCKELSLRB-UHFFFAOYSA-N
ID: 61389
SMILES:C1CC(=C(C)C)C23CCC1(C)Oc1ccc(CCCCC)cc1OC2C3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -15.112
InChIKey:CQEAKRUTGKZNSU-UHFFFAOYSA-N
ID: 61390
SMILES:C(C)(C)=CCCC(C)=CCCC(C)=CCc1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 384.604
CB1 binding score: -20.123
InChIKey:WYEFRBILENQYOH-UHFFFAOYSA-N
ID: 61391
SMILES:Oc1c(C)c(C=CC(C)(C)O)cc2c1OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Miscellaneous meroterpenoids
MW: 342.479
CB1 binding score: -16.005
InChIKey:HXAGNGVAXCUIGZ-UHFFFAOYSA-N
ID: 61392
SMILES:C=C1CC(O)C2(O)C1c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -12.097
InChIKey:HYLNWXZUPSTLQU-UHFFFAOYSA-N
ID: 61393
SMILES:C(CCC)Cc1c(O)cc(O)c(CC=C(CCC=C(C)C)C)c1
Pathway: Polyketides
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 316.485
CB1 binding score: -17.394
InChIKey:MYUUBTAELPINEG-UHFFFAOYSA-N
ID: 61394
SMILES:O=C(C)Oc1c(CC=C(C)C)c(O)c2c3c1c(cc(OC(C=C)(C)C)c3)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 504.667
CB1 binding score: -14.184
InChIKey:ZTHZRALABLRPLT-UHFFFAOYSA-N
ID: 61395
SMILES:C1C(C)=CCC2C(C)(C)Oc3cc(C(C)C)c(O)c(O)c3C(=O)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -13.394
InChIKey:FNESBWRBLVTXPF-UHFFFAOYSA-N
ID: 61396
SMILES:C1C2(C)OC(O)(C(C)(C)Oc3cc(CCCCC)cc(O)c32)CC2C(C)(CC1=O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.53
CB1 binding score: -14.908
InChIKey:SBMLTXOALYQWIL-UHFFFAOYSA-N
ID: 61397
SMILES:C(CCc1cc(O)c2c(c1)C1C(C(C)(C)O2)CCC(=C)C1)CC(=O)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -13.641
InChIKey:FSKIAYKUZCPUFG-UHFFFAOYSA-N
ID: 61398
SMILES:c1(O)cc(CCCC)cc2c1-c1c(c(CCCCCC)cc(O)c1)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -15.467
InChIKey:TVWVUMZFBUASRX-UHFFFAOYSA-N
ID: 61399
SMILES:c12c(cc(CCCCC)cc1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.189
InChIKey:AIOSXAOKGBOYPS-UHFFFAOYSA-N
ID: 61400
SMILES:O=C1C(C)(O)CC2C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -16.734
InChIKey:VXMHGIRKKJTGGL-UHFFFAOYSA-N
ID: 61401
SMILES:C1(C)C2(C)C3(c4c(cc(CCCCC)cc4O)O1)C(C1C(C)COC1(O)C2)C=C(C)C(=O)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.579
CB1 binding score: -13.832
InChIKey:SHUFTQVOFSVWQI-UHFFFAOYSA-N
ID: 61402
SMILES:C12c3c(cc(CCC)cc3O)OC3(C)CC(C1C(C)(C)O2)C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -15.506
InChIKey:KNNDAMPYEDDNFT-UHFFFAOYSA-N
ID: 61403
SMILES:C1(C(=C)C)CC=C(C)CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.129
InChIKey:ZTGXAWYVTLUPDT-UHFFFAOYSA-N
ID: 61404
SMILES:C1(C)(CO)CC(c2c(O)cc(CCCCC)cc2O)C=C(C)CCC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -15.526
InChIKey:UCNSOKVNGPDEGS-UHFFFAOYSA-N