ID: 51052
SMILES:O=C1C(C(=CC)C)C2Oc3c(c(O)cc(C)c3)C3C2(O3)C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.381
CB1 binding score: -16.076
InChIKey:AYZXCPLXVHSMKS-UHFFFAOYSA-N
ID: 51053
SMILES:C1C(O)C(C)C2C(C1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.973
InChIKey:ZQPRCRGWHGYNRY-UHFFFAOYSA-N
ID: 51054
SMILES:OCC(=O)Oc1cc(CCCCC)cc2c1C1C3(O2)OC(C)(C)C3CCC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -15.929
InChIKey:RHOSETBSXPPRDY-UHFFFAOYSA-N
ID: 51055
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1=CCC(C)(O)C12)CCN
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 317.429
CB1 binding score: -15.981
InChIKey:HJJYJFJMXLARJS-UHFFFAOYSA-N
ID: 51056
SMILES:Oc1cc(CCCCC)cc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 51057
SMILES:C1=CC(C)(C)Oc2c(c(O)cc(CCCCC)c2)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -15.992
InChIKey:DUTGIZWVZOOFQB-UHFFFAOYSA-N
ID: 51058
SMILES:c12c(c(C(C(C)C)=O)c(O)cc1O)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -17.896
InChIKey:YAFMVAAAXLTYHW-UHFFFAOYSA-N
ID: 51059
SMILES:C(=C(C)C)CCC(=CCc1c(O)c(O)c(C(=O)O)c(CCCCC)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -18.279
InChIKey:SPBBBNVMIYXEGK-UHFFFAOYSA-N
ID: 51060
SMILES:C12C3=C(c4c(cc(CCCCC)cc4O)OC3(C)C)C(C(CC=CC(C)(C)O)=C)CC1(C)C(C)CCC2O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 522.77
CB1 binding score: -17.547
InChIKey:NTFDBMRIYPHRAN-UHFFFAOYSA-N
ID: 51061
SMILES:O1C(C)(C)C2CC=C(C)CC2c2c(O)cc(CCCC(C)C)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.964
InChIKey:NVOPEPXNFPWHIE-UHFFFAOYSA-N
ID: 51062
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 51063
SMILES:CC1(C)C2CC=C(C)c3c2c(cc(CCCCC)c3)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 270.416
CB1 binding score: -14.805
InChIKey:OJZWSUXXIBYLHS-UHFFFAOYSA-N
ID: 51064
SMILES:C(CCC)Cc1cc2c(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: 51065
SMILES:C(CC)CCc1cc2c(c(O)c1CC=C(C)C)C=C(C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -14.616
InChIKey:UJJHORJDMNONRE-UHFFFAOYSA-N
ID: 51066
SMILES:C1CCC(C)=CCCc2C(C)(C)Oc3c(c(O)c(C(=O)OC)c(CCCCC)c3O)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.585
CB1 binding score: -14.964
InChIKey:LVPZSSVVQOWNBT-UHFFFAOYSA-N
ID: 51067
SMILES:c1(CCCCC)cc2c3c(c1O)OC(C)(C)C1CCC(O)(C)C3CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.95
InChIKey:QLHHNPWZRDJTOP-UHFFFAOYSA-N
ID: 51068
SMILES:Oc1c2c(cc(C)c1)C1C(CCC(C)(CCCC(=CC=O)C)O1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -13.433
InChIKey:BPONQLASUVTXCQ-UHFFFAOYSA-N
ID: 51069
SMILES:C(C)(C1=CC(OC)C(O)(C)C2C1c1c(O)cc(CCCC)cc1O2)=C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.987
InChIKey:AGZSHRUMWJMXEO-UHFFFAOYSA-N
ID: 51070
SMILES:C1(C(C)C)C(c2c(O)cc(CCCC)cc2O)C=C(COC(C(C)(C)C)=O)C(=O)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -14.781
InChIKey:KNQRZGJVSNWHKF-UHFFFAOYSA-N
ID: 51071
SMILES:c1(CC=C(CCC=CC)C)c(O)c2c(cc1C)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -13.686
InChIKey:MDZWWFQSIZEXCT-UHFFFAOYSA-N
ID: 51072
SMILES:C1C(C)=CC2C(C(C)(C)Oc3c2c(O)cc(CCCC)c3)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N