ID: 84043
SMILES:CCCCCCc1cc2c(c(O)c1)C1C(C(C)(O)CC2)CC(C(C)(O)C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.537
CB1 binding score: -16.814
InChIKey:ATBPHNUZGPHYLD-UHFFFAOYSA-N
ID: 84044
SMILES:c1c(CC=C(C)CCC=C(C)C)cc(C2C(C(C)=C)CCC(C)=C2)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.573
CB1 binding score: -19.077
InChIKey:UYOQCGMZXXSXRT-UHFFFAOYSA-N
ID: 84045
SMILES:C123C(C(C(O)=O)(C)CCC1)C(c1c(O)cc(CCCCC)cc1O2)OC3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -12.669
InChIKey:HEKFZOFPCLXEJY-UHFFFAOYSA-N
ID: 84046
SMILES:C(CCc1cc2c(c(O)c1)C1C(CC=C(C)C1)C(C)(C)O2)C(O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.868
InChIKey:XSBHZVGLQYLWOT-UHFFFAOYSA-N
ID: 84047
SMILES:C1(O)C2=C(c3c(cc(CCCCC)c(C(O)=O)c3O)OC2(C)C)CC(C)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.46
CB1 binding score: -15.929
InChIKey:WKMFEFQCDJMFKN-UHFFFAOYSA-N
ID: 84048
SMILES:C(O)C(c1c2c(c(=O)cc(CCCC)c1O)OC(C)(C)C1CCC(C)C(=C2)O1)(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -15.686
InChIKey:ULBHCCPQYWCXCN-UHFFFAOYSA-N
ID: 84049
SMILES:c12c(c(O)cc(CCCCC)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 84050
SMILES:C(CCC)c1c(C=O)c(O)c(C2C=C(C)C(CC=C(C)C)O2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -14.752
InChIKey:LYQVEBYLJCKGIR-UHFFFAOYSA-N
ID: 84051
SMILES:CC(C)CCC(c1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -18.872
InChIKey:QYPCCIVUJGOZMM-UHFFFAOYSA-N
ID: 84052
SMILES:C(C)c1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -18.585
InChIKey:DNTBFILTGOCICF-UHFFFAOYSA-N
ID: 84053
SMILES:C1(O)C2C(c3c(O)cc(CCC(O)CC)cc3O1)CC(C(CO)=C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -15.455
InChIKey:ZASODUPWRPYSDF-UHFFFAOYSA-N
ID: 84054
SMILES:O1C(C)CC2=C1c1c(cc(CCCCC)c(C(=O)O)c1O)OC2(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.423
CB1 binding score: -15.994
InChIKey:ZVHLURSMZMHRFI-UHFFFAOYSA-N
ID: 84055
SMILES:CC1(C)C(CCC2(C)Oc3c(O)c(OC)cc(CCCCC)c3)CC2CCC1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.619
CB1 binding score: -12.657
InChIKey:MSULWVHCIQWOEO-UHFFFAOYSA-N
ID: 84056
SMILES:O=C1C(C)C2(C(O)C(C)=C1)c1c(cc2)C(C)(C)Oc2c(c(O)cc(CCC)c2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.511
CB1 binding score: -14.984
InChIKey:IGMRAMVOUUHMMZ-UHFFFAOYSA-N
ID: 84057
SMILES:C1(C(C)COC(C)=O)CCC(O)(C)C2Oc3c(c(O)cc(CCCCC)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -18.228
InChIKey:QQTWUVISLLRIJY-UHFFFAOYSA-N
ID: 84058
SMILES:C(CC)CCc1cc2c(c(O)c1)C1C(C(O)(CC=CC(C)(C)OC)C)CC(C)(O2)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.629
CB1 binding score: -15.796
InChIKey:VDDYORGWGSNOAC-UHFFFAOYSA-N
ID: 84059
SMILES:OCC(Cc1cc(O)c(C2C=C(C)CCC2C(=C)C)cc1O)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -15.429
InChIKey:JRVDYQKFRTVYGE-UHFFFAOYSA-N
ID: 84060
SMILES:C1(C)C2C(OC1)c1c(cc(CCCCC)cc1O)OC(C)(C)C2CCC(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -14.435
InChIKey:GRLOKRKUIZDDNN-UHFFFAOYSA-N
ID: 84061
SMILES:C1=CC(C)(C)Oc2cc(CCCCCCC)cc(OC)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -16.113
InChIKey:LPVJWTXEHDSBAC-UHFFFAOYSA-N
ID: 84062
SMILES:Oc1cc(CCCCC)cc2c1-c1c(c3c(cc1O)OC14C(C)(C(C)CCC1C(C)(C)O3)C4)CC(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 506.683
CB1 binding score: -13.117
InChIKey:DBEQBTXMDLYQKR-UHFFFAOYSA-N
ID: 84063
SMILES:c1(CCCCC)cc(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