ID: 89650
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2(O)C(C(C)(C)C(=O)C2)CCC1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -14.652
InChIKey:IQHRAIXGNSAHRR-UHFFFAOYSA-N
ID: 89651
SMILES:C(C=C(C)C1Cc2c(c(C)cc(O)c2-c2c(O)cc(CCCCC)cc2O)C=C(C)CC1)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 488.712
CB1 binding score: -15.221
InChIKey:SLTXOPAVJCJMAH-UHFFFAOYSA-N
ID: 89652
SMILES:C(C)CCCc1cc(O)cc2c1C1C(C(=C)C)CCC(C)(C2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -13.678
InChIKey:XZVZRWPNERGEAN-UHFFFAOYSA-N
ID: 89653
SMILES:c1(O)cc(CC=C(C)CCC=C(C)C)c(O)cc1COC(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -16.349
InChIKey:RARUNEBGAJPJKV-UHFFFAOYSA-N
ID: 89654
SMILES:C1=CC(C)(CCC=C(C)CCC=C(C)C)Oc2cc(CCCCC)c(C(=O)O)c(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -17.872
InChIKey:PIWDPVFUVKGKSR-UHFFFAOYSA-N
ID: 89655
SMILES:c1(CCCCC)cc2c(c(O)c1)C1CC(C)(C)CC3CC(C)C(OC=C=C13)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -15.554
InChIKey:PPNZUWPCWZZVGW-UHFFFAOYSA-N
ID: 89656
SMILES:C12(C)CCC(C)CC(=O)C=C(C(=O)OC)CC1c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -10.356
InChIKey:AIKMWOICBDFRIP-UHFFFAOYSA-N
ID: 89657
SMILES:O(C(=O)C)c1cc2c3c(c1)OC1(C)C3CC(C(=C)C)CC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -15.635
InChIKey:YHWKFNJHYNMXIT-UHFFFAOYSA-N
ID: 89658
SMILES:OCC(C)=CCc1cc(O)c(CC=C(CCC=C(C)C)C)c(O)c1CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -15.22
InChIKey:FOOJVSAGOMLXSB-UHFFFAOYSA-N
ID: 89659
SMILES:CC1=CC2C(CC1)C(CO)(C)Oc1cc(C)c(O)cc12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.495
InChIKey:KXDAADNEVRLBMT-UHFFFAOYSA-N
ID: 89660
SMILES:CC(=C)C1CCC(=C)C2C(c3c(O)cc(CCCCC)cc3O2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -15.227
InChIKey:YONCBOMFUASCNL-UHFFFAOYSA-N
ID: 89661
SMILES:C(CCCC)c1cc(O)c2c(c1O)C1CC(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -16.083
InChIKey:IWIPUFYADDWQAH-UHFFFAOYSA-N
ID: 89662
SMILES:c1(CC)c(C)c2c(c(O)c1C=O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -12.519
InChIKey:CKARVVQLGZBEHZ-UHFFFAOYSA-N
ID: 89663
SMILES:c1(CCCC)cc(O)c2c(c1)OC(C)(C)C1CCC(C(OC)=O)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.334
InChIKey:IVOMNWVMBRMVJJ-UHFFFAOYSA-N
ID: 89664
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -20.807
InChIKey:KSGRDIFQZVURIF-UHFFFAOYSA-N
ID: 89665
SMILES:C12CC(CCC(C)=CCCC1=C)C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -15.327
InChIKey:OGIZMDIJGZMKCN-UHFFFAOYSA-N
ID: 89666
SMILES:C=C1C2C(O)CC(OC)(C)C3OC32c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -14.699
InChIKey:LPQVLAMKHNMWOW-UHFFFAOYSA-N
ID: 89667
SMILES:Oc1c2c(c(CCCCC)cc1O)OC(CO)(C)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 266.337
CB1 binding score: -13.23
InChIKey:DCBCIYSAVJJQQW-UHFFFAOYSA-N
ID: 89668
SMILES:Oc1cc(CC=C(C)CCC=C(C)C)c(O)c2c1C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -16.246
InChIKey:AZFQGKDQTQMEFR-UHFFFAOYSA-N
ID: 89669
SMILES:c1c(CCCCC)cc2c(c1O)C1C(O)C(C)(O)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -19.298
InChIKey:TZGCTXUTNDNTTE-UHFFFAOYSA-N
ID: 89670
SMILES:C(Cc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(CCC=C(C)C)O2)(=O)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -17.388
InChIKey:GBMSOSFWPZYCLS-UHFFFAOYSA-N