ID: 57772
SMILES:c1cc(C2C=C(C)CCC2C(=C)C)c(OC)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -18.382
InChIKey:PIWOIVDTYQHIGV-UHFFFAOYSA-N
ID: 57773
SMILES:C(C)CCCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 57774
SMILES:C1CC2(C)C(C3c4c(cc(CCCCC)cc4O)OC(C)(C)C3CC2)C2OC(=O)C(O)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.623
CB1 binding score: -15.929
InChIKey:SXFGBQPHKSMBNN-UHFFFAOYSA-N
ID: 57775
SMILES:O(C1CC(C)(Cl)C2C(c3c(O)cc(CCCCC)cc31)OC(C)(C)C2C)C(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.993
CB1 binding score: -15.846
InChIKey:ZZOOQXIKNZIGSE-UHFFFAOYSA-N
ID: 57776
SMILES:c1(CCCCC)ccc2c(c1O)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.141
InChIKey:XFSLHYHFWBPGED-UHFFFAOYSA-N
ID: 57777
SMILES:c12c(c(O)cc(CCCCC)c1)C1C(CC2)C(C)(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -18.604
InChIKey:KQHWPJKXHSYBGV-UHFFFAOYSA-N
ID: 57778
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 57779
SMILES:CC(C1(C)C(c2c(O)cc(CCCCC)cc2O)CC(C)=CC1=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -14.364
InChIKey:HIDYTXGLHKPRBD-UHFFFAOYSA-N
ID: 57780
SMILES:Cc1ccc2c(c1)-c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 57781
SMILES:O1c2cc(CCCCC)cc(O)c2C2C=C(C)CCC2C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 57782
SMILES:C(Cc1cc2c(c(O)c1)CC(O)C(C)(C)O2)CC(C(O)CC=C(CCC=C(C)C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.629
CB1 binding score: -14.257
InChIKey:WRGBSDLVYHPSDW-UHFFFAOYSA-N
ID: 57783
SMILES:O=Sc1cc2c(cc1)OC(C)(C)C1CC=C(C)CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.401
CB1 binding score: -16.533
InChIKey:GBOMRRBJQLDVIR-UHFFFAOYSA-N
ID: 57784
SMILES:OC1C(C)(C)Oc2c1c(=O)cc(CCCCC)cc2O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.348
CB1 binding score: -14.981
InChIKey:VDWVHXPLXPWKCA-UHFFFAOYSA-N
ID: 57785
SMILES:Oc1c2c(cc(CCC)c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.805
InChIKey:CDBDULHNWQRYSY-UHFFFAOYSA-N
ID: 57786
SMILES:C(C)(CCC=C(C)C)=CCc1c(O)cc(CCCCC)c(C(O)=O)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 57787
SMILES:c12c(OC)cc(CC=C)cc1OC(C)(C)C1CC(O)C(O)(C)CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -14.632
InChIKey:BNAGNTIHYDEKAY-UHFFFAOYSA-N
ID: 57788
SMILES:c1(O)cc(CCCCC)cc2c1C1C(C3(C)CCC(C(C)(O)C)OC3C1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -17.43
InChIKey:ZWGXSGXMDYWIIX-UHFFFAOYSA-N
ID: 57789
SMILES:CC1(C)C2C(c3ccc(CCCCC)cc3)(C1)CCC(C)=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.498
CB1 binding score: -13.787
InChIKey:SVRHSYDRWYNXSA-UHFFFAOYSA-N
ID: 57790
SMILES:C1=C(C)CCC(C(C)=C)C1c1c(O)cc(C)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -19.801
InChIKey:MISWBPJELUDMFI-UHFFFAOYSA-N
ID: 57791
SMILES:C1(O)C(C)(CCC=C(C)C)Oc2cc(CCCCC)c(C(=O)O)c(O)c2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -17.467
InChIKey:KSAFPPBVVHMLQY-UHFFFAOYSA-N
ID: 57792
SMILES:CC1(C)OC2OC3C4C(C(C#CC2)C13)c1c(cc(CCCCC)cc1O)OC4
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.5
CB1 binding score: -14.41
InChIKey:CJGDVHIFVSYPGB-UHFFFAOYSA-N