ID: 61951
SMILES:C1=CC(C)(C)Oc2c1ccc(CCCCC)c2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 230.351
CB1 binding score: -17.825
InChIKey:WRULWNHWZUTIHL-UHFFFAOYSA-N
ID: 61952
SMILES:C(COC1CC2(C)CC2c2c(O)cc(CCCCC)cc21)CC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -14.843
InChIKey:SLGRRSFOQUKSDK-UHFFFAOYSA-N
ID: 61953
SMILES:C(Cc1cc(O)c(C2C(C(C)C)CCC(C)=C2)cc1O)=C(CCC=C(C(O)=O)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -18.186
InChIKey:AURNVLHWSGKCDV-UHFFFAOYSA-N
ID: 61954
SMILES:O(C(C)=O)C1C2(C(O)C)C3C(OC(c4c(C)c5c(cc4C)OC5(C)C)CC3(C)OC2=O)C=C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.562
CB1 binding score: -14.974
InChIKey:AZODPCBXPJTWPT-UHFFFAOYSA-N
ID: 61955
SMILES:C(Cc1cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 61956
SMILES:C(CCCCC(O)c1cc(O)c2c(c1)OC(C(=C)C)C2)CCC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -13.394
InChIKey:RPOVSDHQGQLZQX-UHFFFAOYSA-N
ID: 61957
SMILES:c1(OC)c(C)c(O)cc2c1C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -17.138
InChIKey:DZIWYSSBINWVKS-UHFFFAOYSA-N
ID: 61958
SMILES:C1(C)Cc2c(c(C(=O)O)cc(CCCCC)c2O)C=C1CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -15.176
InChIKey:IHYGZOQUCSPIGU-UHFFFAOYSA-N
ID: 61959
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: 61960
SMILES:Oc1cc2c(c(Cl)c1)OC(C)(C)C1CCC(C)(O)C(O)CCC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.912
CB1 binding score: -13.632
InChIKey:QYHMMFXWLWITOX-UHFFFAOYSA-N
ID: 61961
SMILES:c12ccc(O)c(c1)CC(O)C(C)(C)Oc1cc(CCCCC)ccc12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -16.263
InChIKey:BJPFEXRZHLBQIO-UHFFFAOYSA-N
ID: 61962
SMILES:OCCCC1C(C)(C)Oc2cc(C)cc(O)c2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 250.338
CB1 binding score: -16.155
InChIKey:AJFVFFXNXAVWNL-UHFFFAOYSA-N
ID: 61963
SMILES:C(C)CCc1cc2c(c(O)c1)C1C(CCC(=C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -18.009
InChIKey:AHNDOCSOZYPQHA-UHFFFAOYSA-N
ID: 61964
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C(=O)OC)=CC1)(CCCC(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -12.911
InChIKey:HUOGDUHWWCUTNK-UHFFFAOYSA-N
ID: 61965
SMILES:C1(C)=CC(c2c(O)cc(CCCCC)cc2O)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 61966
SMILES:C(CCCc1cc(C(O)=O)c(O)c2c1OC(C)(C)C1CCC(C)(O)CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -15.348
InChIKey:WBSPVWZHSJMPJY-UHFFFAOYSA-N
ID: 61967
SMILES:C1c2c(cc(CCCCC)cc2O)OC2(C)C1=C(O)C1C(=C)CC1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -15.706
InChIKey:SZPFCZAGOGRMHE-UHFFFAOYSA-N
ID: 61968
SMILES:C1c2c(cc(CCCC)cc2O)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.378
CB1 binding score: -14.309
InChIKey:VYISPEAPVFWDHB-UHFFFAOYSA-N
ID: 61969
SMILES:c1(O)c(CCCC)cc2c(c1O)C1C3(CCC(C)C1(C)C=C(C)C(C)=C)C(=O)c1c(c(C)cc(O)c1C)OC3(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 560.731
CB1 binding score: -15.512
InChIKey:RVYDJZXRHZRXSS-UHFFFAOYSA-N
ID: 61970
SMILES:c1(O)cc(CCCCC)cc2c1C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 61971
SMILES:C(CCC)CCCc1cc(O)c2c(c1)OC(CCC=C(C)C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -17.334
InChIKey:MFRLGFBNEKYGNS-UHFFFAOYSA-N