ID: 68335
SMILES:CC(C)C1CCC(=C)CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.51
InChIKey:ABUYMDYRFWRXCE-UHFFFAOYSA-N
ID: 68336
SMILES:Oc1c(C(C(C)C)=O)c(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -17.189
InChIKey:ZYWUQCDKZKKBOG-UHFFFAOYSA-N
ID: 68337
SMILES:c1c2c(cc(CCCCC)c1)OC(CCC1(C)C(C)=CC(O)C=C1C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -14.625
InChIKey:NWHKQBIRNXVQAS-UHFFFAOYSA-N
ID: 68338
SMILES:C1CC2C(c3c(cc(CCCCC)cc3O)OC2(C)C)=CC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.254
InChIKey:TWCZERMIPVKWLM-UHFFFAOYSA-N
ID: 68339
SMILES:c1(CCCC)cc(C2C(C(C)=C)CCC(C)=C2)ccc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 268.444
CB1 binding score: -19.163
InChIKey:WHEQNDVLHQQILY-UHFFFAOYSA-N
ID: 68340
SMILES:C(=O)(Cc1c(O)c2c(cc1C)OC(C)(C)C1C2C=C(C)CC1)C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -12.834
InChIKey:CNUXCKUBKKRDSO-UHFFFAOYSA-N
ID: 68341
SMILES:CC(=CCCC1(C)Oc2cc(CCCCC)cc(O)c2C=C1)C(CCC(CO)C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: -12.918
InChIKey:LPGREPOTKJUVRL-UHFFFAOYSA-N
ID: 68342
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(C(O)(C)CCC=C(C)C)(CC2=O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -7.641
InChIKey:LSZTWUUMQHAGGT-UHFFFAOYSA-N
ID: 68343
SMILES:CC1=CC2C(C(C)(C)Oc3c(c(O)c(C(=O)C(CC)C)c(O)c32)CC=C(C)C)CCC2(C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.662
CB1 binding score: -16.61
InChIKey:AWZMPDYMEZJGOF-UHFFFAOYSA-N
ID: 68344
SMILES:c1c(CCCC)c(C(=O)O)c(O)c2c1OC(C)(C)C1C2CC(C)(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -16.542
InChIKey:CBMNOFDKLPMKKZ-UHFFFAOYSA-N
ID: 68345
SMILES:OC(c1c(O)c2c(cc1C)OC(CCC1(C)C(C)CCC=C1C)(C)C(OC)C2)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.683
CB1 binding score: -15.063
InChIKey:KEDIMRKLKTXJCE-UHFFFAOYSA-N
ID: 68346
SMILES:c12c(c(O)cc(CCCCC)c1)C1C(C(C)=C)CC(O)C(CO)(O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.117
InChIKey:XAKQYOCOQKXJEK-UHFFFAOYSA-N
ID: 68347
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 68348
SMILES:O=C(C(C)C)OC1CCC(C)C2(C(OC(C)=O)c3c(OC)cc(CCCC)cc3O2)C1C1(C)CO1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 488.621
CB1 binding score: -12.849
InChIKey:LJVIHSWHSAVAAQ-UHFFFAOYSA-N
ID: 68349
SMILES:Oc1cc(CCCC)cc2c1C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 68350
SMILES:c1(CCCCC)cc2c(c(O)c1)CC1CC(C(C)C)C=CC1(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.594
InChIKey:KFYLKRXIRBFCSL-UHFFFAOYSA-N
ID: 68351
SMILES:O(C(=O)C)C1C2(CCC(=O)C2(C)C)C2(OC2)CC2c3c(cc(C)cc3O)OC(C)(C)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 428.525
CB1 binding score: -13.015
InChIKey:QSDCWSNLKCAQGK-UHFFFAOYSA-N
ID: 68352
SMILES:C1C(O)C(C)C2C1c1c(cc(CCCCC)c(C(=O)O)c1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -14.008
InChIKey:FLZWCQUMUARFRE-UHFFFAOYSA-N
ID: 68353
SMILES:C(C)(=CCc1c(O)cc(CCCCC)cc1)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 300.486
CB1 binding score: -19.003
InChIKey:KXYIDYXHLDYCQN-UHFFFAOYSA-N
ID: 68354
SMILES:c1(CCC)ccc(O)c(C2C(C(C)=C)CC(O)C(C)=C2)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -15.739
InChIKey:CYZJOZWICJKGPL-UHFFFAOYSA-N
ID: 68355
SMILES:CC1(C)Oc2c(c(O)cc(C=CC(=O)O)c2)C2C=C(C)CCC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.381
CB1 binding score: -18.211
InChIKey:QIMSEPJQFRYMMU-UHFFFAOYSA-N