ID: 44626
SMILES:C1(CCC(Cl)(C)C)(C2CC2C(C)=C)Oc2c(c(O)cc(CCCCC)c2)CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 421.021
CB1 binding score: -13.978
InChIKey:ZUTHPSFIROSQEC-UHFFFAOYSA-N
ID: 44627
SMILES:c1(CCCCC)cc2c(c(O)c1C=O)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -17.972
InChIKey:XMFATGXZFZMSFO-UHFFFAOYSA-N
ID: 44628
SMILES:C1(C)(C)C2CC=C(C)CC2c2c(cccc2)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 228.335
CB1 binding score: -18.418
InChIKey:UEUDZYHJJLDGIZ-UHFFFAOYSA-N
ID: 44629
SMILES:C1(C(C)C)C(c2c(O)cc(CCCC)cc2O)CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -17.334
InChIKey:UOQAQJLARPRUBJ-UHFFFAOYSA-N
ID: 44630
SMILES:CC1(c2c(OC)cc(CCCCC)cc2O)C2CC2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -15.517
InChIKey:DEDVMFLOVDPXNY-UHFFFAOYSA-N
ID: 44631
SMILES:Oc1c(C(C(CC)C)=O)c(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.078
InChIKey:ZJYYXCGFEUARDG-UHFFFAOYSA-N
ID: 44632
SMILES:CC1=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)c(C(=O)O)c(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -19.351
InChIKey:UCONUSSAWGCZMV-UHFFFAOYSA-N
ID: 44633
SMILES:C1(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 44634
SMILES:C1C2(c3c(cc(CCCCC)cc3O)OC2(C)C)C(O)CC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.699
InChIKey:DSIMDHFOUYZCAY-UHFFFAOYSA-N
ID: 44635
SMILES:C(CCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CC=C(C)C1)C=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -16.63
InChIKey:IUHVBXKBQKCRRZ-UHFFFAOYSA-N
ID: 44636
SMILES:C(=O)(CC(c1c(CCC(OCC)=O)cc2c(c1)C1C=C(C)CCC1C(C)(C)O2)=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.526
CB1 binding score: -14.972
InChIKey:FTFOZRLIFKWAAX-UHFFFAOYSA-N
ID: 44637
SMILES:c1(C(=O)OC(C)O)c(CCC)cc2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -12.235
InChIKey:JUTUUJLUADNBDJ-UHFFFAOYSA-N
ID: 44638
SMILES:c1(O)cc(CCCCC)c(C(=O)O)c(O)c1CC=C(C)CCC(C(C)(O)C)O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.508
CB1 binding score: -16.844
InChIKey:DXMRIITZCLCWPZ-UHFFFAOYSA-N
ID: 44639
SMILES:C1(C)(C)C2CCC(C)=CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 44640
SMILES:C(c1c(OC)c(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)C=CC(C)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.626
InChIKey:HXKGYYMQCFTTPQ-UHFFFAOYSA-N
ID: 44641
SMILES:CC(C)=CCCC(C)=CCc1c(O)cc(CCC)c(C(O)=O)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -19.667
InChIKey:FAVCTJGKHFHFHJ-UHFFFAOYSA-N
ID: 44642
SMILES:c1(O)c(CC=C(CCC=C(C)CCC=C(C)C)C)c(O)cc(CCc2cc(O)cc(OC)c2)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.646
CB1 binding score: -16.906
InChIKey:HHRSKDJQUUNAFD-UHFFFAOYSA-N
ID: 44643
SMILES:C(CCCC)c1cc(O)c(CC=C(CCC=C(C)C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 44644
SMILES:C1CC2C(=CC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -17.491
InChIKey:DBJQWHZCHFFVCF-UHFFFAOYSA-N
ID: 44645
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C(=O)O)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.707
InChIKey:OGXXAQFMAFTSRU-UHFFFAOYSA-N
ID: 44646
SMILES:C1=C(C)CC2(O)C(C(C)(C)Oc3c2c(O)cc(C)c3)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -16.502
InChIKey:BSXZBSMOSDGDTR-UHFFFAOYSA-N