ID: 49666
SMILES:C(=Cc1c2c(cc(OC)c1C)OC(C)(C)C1CCC(C)=CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -15.892
InChIKey:CFZIHBBQTDUZJD-UHFFFAOYSA-N
ID: 49667
SMILES:C(C)(=CCCC(C)=CCc1cc(C(=O)O)c2c(c1)OC(C)(C)C1CCC(C(=O)O)=CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.564
CB1 binding score: -13.648
InChIKey:SEUSPZKIXYHKDU-UHFFFAOYSA-N
ID: 49668
SMILES:Cc1c(CCCCC)cc2c(c1O)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.218
InChIKey:CNCURDLLOPZUIO-UHFFFAOYSA-N
ID: 49669
SMILES:CC(CC(c1c(O)c2c(cc1C)OC(C)(C)C1CCC(C)=CC12)C)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -13.987
InChIKey:PSHSSAOWMTVTSX-UHFFFAOYSA-N
ID: 49670
SMILES:c1(CCCCC)cc(O)c2c(c1C(=O)O)CC1C(CCC(O)C(C(=O)OC)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.54
CB1 binding score: -15.507
InChIKey:KAOZPPDTFWTSGX-UHFFFAOYSA-N
ID: 49671
SMILES:C(C=C(C)C)CC(C)=CCc1c(C)c2c(cc1O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.599
CB1 binding score: -16.247
InChIKey:ATBNHEDBVJWGON-UHFFFAOYSA-N
ID: 49672
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1C2C=C(CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 49673
SMILES:C(Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1CC2C(C)C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -14.667
InChIKey:SSUCZLIAQIHZPK-UHFFFAOYSA-N
ID: 49674
SMILES:c1c(C2C(C(C)(C)C)CC(O)C(C)=C2)c(O)cc(OC)c1CC=C(CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.641
CB1 binding score: -16.502
InChIKey:QDFPBRJYEJFBMG-UHFFFAOYSA-N
ID: 49675
SMILES:COc1cc(CCc2ccccc2)cc2c1C1CC(C)=CCC1C(C)(C)O2
Pathway: Shikimates and Phenylpropanoids;Terpenoids
Superclass: Meroterpenoids;Stilbenoids
Class: Cannabinoids;Monomeric stilbenes
MW: 362.513
CB1 binding score: -15.929
InChIKey:BHBLXODVHJJEIL-UHFFFAOYSA-N
ID: 49676
SMILES:C1(C)C(O)CC2C3(CO2)C1c1c(O)cc(C)cc1OC3(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -16.606
InChIKey:CUPMFYDSEXGGAT-UHFFFAOYSA-N
ID: 49677
SMILES:C12(C(C)(C)Oc3cc(CCCCC)cc(O)c31)Oc1c(c(C)c(OC)cc1C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.499
CB1 binding score: Not available
InChIKey:FZFFLSWJXGASBH-UHFFFAOYSA-N
ID: 49678
SMILES:C1CCC2(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -15.045
InChIKey:IATBJAYTNVBPJD-UHFFFAOYSA-N
ID: 49679
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1C(C(C)CC1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.026
InChIKey:UWJTXRBBWOXUPZ-UHFFFAOYSA-N
ID: 49680
SMILES:CC1(C)C2C3C2c2c(cc(CCCCC)c(C(=O)O)c2O1)O3
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -15.916
InChIKey:OPFBQINXSXKWCO-UHFFFAOYSA-N
ID: 49681
SMILES:C1(=O)CC2(c3c(cc(CCCCC)c(C(=O)O)c3O)OC1(CCCCCC)C)C(C)(C)C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 486.693
CB1 binding score: -17.439
InChIKey:BKMDWHNWYAZZJO-UHFFFAOYSA-N
ID: 49682
SMILES:c1(CCCCC)cc2c(c(O)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: 49683
SMILES:C(OC1C(C)=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2C1)(C)=CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -15.602
InChIKey:LXFJBQXUCVJTKK-UHFFFAOYSA-N
ID: 49684
SMILES:C1C(CC(=O)OC)C(C)(C)C2=CC3=C(CO)C(=O)C(O)=C(CC3)CCc3c(O)cc(CCCC)cc3OC21C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 538.681
CB1 binding score: -15.887
InChIKey:CZKCQULDWMRRRK-UHFFFAOYSA-N
ID: 49685
SMILES:c1cc2c3c(c1)OC1(C)CC=C(C(C)C)C(C31)C(OC)(C1C=CCC(C)(C)O1)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.527
CB1 binding score: -16.829
InChIKey:SCOAKQISRQSDAN-UHFFFAOYSA-N
ID: 49686
SMILES:C(CCCc1cc(O)c(CC=C(C)CCC=C(C)C)c(OC)c1)c1ccccc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.583
CB1 binding score: -16.132
InChIKey:HFWOULIAFGPHPR-UHFFFAOYSA-N