ID: 47650
SMILES:CC(CCC=C(C)C)=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 47651
SMILES:OC1C(C)C2=C(c3c(cc(CCCCC)cc3O)OC2OC)C(C(=C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.337
InChIKey:KDZQIGOHEFBVGT-UHFFFAOYSA-N
ID: 47652
SMILES:C1(C)(C)C2(C(=C)CC(O)C1Cl)Cc1c(O)cc(CCCCC)cc1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.913
CB1 binding score: -15.7
InChIKey:MAZDFEKHCBFNTM-UHFFFAOYSA-N
ID: 47653
SMILES:C1CCC(CCCC(O)(C)C)(C)Oc2c1cc(CCCCCO)cc2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.526
CB1 binding score: -14.575
InChIKey:QTVHBLJSQMTFKU-UHFFFAOYSA-N
ID: 47654
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2(C)C(=C1)C(O)CC(OC(=O)C)C2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -14.68
InChIKey:NULGMNUNRFKQJU-UHFFFAOYSA-N
ID: 47655
SMILES:CC(C)(C1C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.812
InChIKey:FTDORWGKHUOHKJ-UHFFFAOYSA-N
ID: 47656
SMILES:C(CCC)CCCCCCCCCCCCCC(O)Cc1cc2c(c(O)c1)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 526.846
CB1 binding score: -16.324
InChIKey:CSMZKNQDHZBYBC-UHFFFAOYSA-N
ID: 47657
SMILES:OCC(O)c1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -16.27
InChIKey:WFGCMQUFSHSNLD-UHFFFAOYSA-N
ID: 47658
SMILES:C=C(C=C1Oc2c(c(O)cc(CCCCC)c2)C2C1CC1(C)CC3OC(=O)C(C)=C3C(O)C1C(=C)C2)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 504.667
CB1 binding score: -15.372
InChIKey:NOVZWWXGMSDGQF-UHFFFAOYSA-N
ID: 47659
SMILES:c1(CCCCC)c(O)c(C2OC(CO)C(O)C(O)C2O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 476.61
CB1 binding score: -16.583
InChIKey:OWDJWAONYMMBMX-UHFFFAOYSA-N
ID: 47660
SMILES:C1C=C(C)CCC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C2C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -19.032
InChIKey:NJSZRBFBYZMAGU-UHFFFAOYSA-N
ID: 47661
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1CCC(O)(C)CC12)CC(CO)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -14.012
InChIKey:FKJXWDFJSBPARI-UHFFFAOYSA-N
ID: 47662
SMILES:CC1=CC2C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 47663
SMILES:CC1=CC2C(C(C)(C)Oc3c2c(O)cc(O)c3)CC1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.316
CB1 binding score: -16.921
InChIKey:AXBYMFVWTUCOCN-UHFFFAOYSA-N
ID: 47664
SMILES:C(c1c(O)c(C=O)c(O)c2c1OC1C=C(C)CCC1C(C)(C)O2)CCCCCCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.612
CB1 binding score: -14.744
InChIKey:CKBYHDUDUVGPMQ-UHFFFAOYSA-N
ID: 47665
SMILES:C(CCC)Cc1cc(O)c(CC=C(C)CCC=C(C)C)cc1
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: 47666
SMILES:C1(C)CCC2C(C)(C)Oc3c(c(O)cc(C)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -18.57
InChIKey:JWVNDMUNWMFDDK-UHFFFAOYSA-N
ID: 47667
SMILES:C(CCC)c1ccc2c(c1O)OC(CCC=C(C)C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -15.063
InChIKey:BCJZMSRVELPNJV-UHFFFAOYSA-N
ID: 47668
SMILES:c12cc(C)c(Br)cc1-c1c(c(O)cc(CCCCC)c1)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 389.333
CB1 binding score: -15.929
InChIKey:NJQVJTFTYFHNSO-UHFFFAOYSA-N
ID: 47669
SMILES:c12c(c(O)cc(CCCCC)c1)C1C(C3C2C1OC(C)=O)OCC3
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -16.46
InChIKey:ZHRAGDLZSZHKBM-UHFFFAOYSA-N
ID: 47670
SMILES:C1C(C)=CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N