ID: 110104
SMILES:O=C1C(=O)c2c(O)cc(CCCCC)cc2OC1(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.332
CB1 binding score: -18.334
InChIKey:HJLDQSFDBVFHQA-UHFFFAOYSA-N
ID: 110105
SMILES:CC(C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 110106
SMILES:C1(C)(O)CC2=C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.269
InChIKey:SEZYEGYUECNXNK-UHFFFAOYSA-N
ID: 110107
SMILES:C1(O)C(CO)(O)C2C(C(C(C)C)C1)Oc1cc(CCCCCC)cc(O)c12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.509
CB1 binding score: -15.833
InChIKey:GFUWBUAVYPVBPY-UHFFFAOYSA-N
ID: 110108
SMILES:C12C=C(C)CCC1C(C)(C)Oc1c2cc(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -20.067
InChIKey:OBJJEVJNCDBGOD-UHFFFAOYSA-N
ID: 110109
SMILES:C(CC)Cc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 110110
SMILES:CC1C2(C(C)CC(CC(=CCc3c(O)c(C)cc(OC)c3)C)OC2(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -14.205
InChIKey:KRSXUTSIQZDXPW-UHFFFAOYSA-N
ID: 110111
SMILES:c1(CCC)cc(O)cc(CC2C(C)(O)CCC2C(=C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -18.451
InChIKey:KZTKHYLAFFAZKN-UHFFFAOYSA-N
ID: 110112
SMILES:c1(CC2C(C(=C)C)CCC(C)=C2)c(O)cc(CCC)cc1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.914
InChIKey:MZCDUFCESVPMEO-UHFFFAOYSA-N
ID: 110113
SMILES:c1(O)cc(CCCCC)cc2c1C1CC(C(C)=C)CCC(C)=C1CCC2=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.573
CB1 binding score: -15.946
InChIKey:HXDASYLSSODVRS-UHFFFAOYSA-N
ID: 110114
SMILES:C1=C(C)C(C)C(C)(c2c(CCCCC)cc(O)cc2O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -13.607
InChIKey:KRUVDRAUDPEOBD-UHFFFAOYSA-N
ID: 110115
SMILES:O1C2C(C(C)C13Oc1cc(CCCCC)cc(O)c1C(C(C)C)C3)CC(C)(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -15.883
InChIKey:JYZJZDBMEPJUSW-UHFFFAOYSA-N
ID: 110116
SMILES:c1c(O)c(CC=C(CCC=C(CCC=C(C)C)C)C)c(O)cc1CCc1ccc(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.62
CB1 binding score: -19.427
InChIKey:VVBVATXKSUVSTB-UHFFFAOYSA-N
ID: 110117
SMILES:C1(c2c3c(c(OC)c(O)c2)C=CC(C)(C)O3)CC(=C)CCC=C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -16.174
InChIKey:DHXHLWZFHLMERS-UHFFFAOYSA-N
ID: 110118
SMILES:C1C2(C=C(C)C1c1ccccc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 230.307
CB1 binding score: -15.708
InChIKey:FMRVRQBWBMDPOX-UHFFFAOYSA-N
ID: 110119
SMILES:C(C1(C)Oc2c(CCCCC)cc(O)cc2CC1O)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -16.516
InChIKey:MZQFIODKYPPADZ-UHFFFAOYSA-N
ID: 110120
SMILES:C1(C)=CC(c2c(O)cc(CCCC)cc2O)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.739
InChIKey:WBRXESQKGXYDOL-UHFFFAOYSA-N
ID: 110121
SMILES:c1(CCCCC)cc2c(c(O)c1)C1CC(C(C)=C)CCC1(C)C(O)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -13.018
InChIKey:NHRNXGLVXHEULA-UHFFFAOYSA-N
ID: 110122
SMILES:C1=C(C)CCC2C(C)(C)Oc3cc(-c4cn(CC(=O)C)cc4)cc(CC=C(C)C)c3C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 417.593
CB1 binding score: -12.198
InChIKey:SPQIEPKDNYOIIS-UHFFFAOYSA-N
ID: 110123
SMILES:c12c(c(C)ccc1)C(c1c(O)cc(CCCCC)cc1O)=CC1(C)C(CCC(C)O)C1(C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.647
CB1 binding score: -13.893
InChIKey:HNYOPFOOXJXWKM-UHFFFAOYSA-N
ID: 110124
SMILES:C(C)(C)=CCCC(C1C(c2c(O)cc(CCC)cc2O)C=C(CO)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -14.254
InChIKey:KTWWVTKVAUJBNP-UHFFFAOYSA-N