ID: 92086
SMILES:CC1=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 92087
SMILES:Oc1cc(CCCCC)cc(O)c1C1OC(=O)C(CCC=C(C)C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.854
InChIKey:ZGNBDHDIIXUCDX-UHFFFAOYSA-N
ID: 92088
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(C(O)=O)=CC21)C(O)C(CCC=C(C)C)(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.595
CB1 binding score: -14.035
InChIKey:WIWMBZGVMYLFSS-UHFFFAOYSA-N
ID: 92089
SMILES:C1(C)=CC(c2c(O)cc(CCCC)cc2)C(C(O)(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -16.676
InChIKey:DQWDRFRUBIPGBU-UHFFFAOYSA-N
ID: 92090
SMILES:C(C)CCc1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.739
InChIKey:WBRXESQKGXYDOL-UHFFFAOYSA-N
ID: 92091
SMILES:CCCCCCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 92092
SMILES:CC1(C)C2CC3C1C(C)(Oc1c(c(O)cc(CCCCC)c1)C3=O)C2CC(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -16.49
InChIKey:DDHHEUPJYCDWAD-UHFFFAOYSA-N
ID: 92093
SMILES:c1c(O)cc(CCCCC)c2c1OC(C)(C)C1C2CC(=C)C=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -11.814
InChIKey:CDFZSPOTOLYUJQ-UHFFFAOYSA-N
ID: 92094
SMILES:C(C=C(C)C)CC1(C)Oc2cc(CCCCC)c(C(=O)O)c(O)c2C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.775
InChIKey:HRHJHXJQMNWQTF-UHFFFAOYSA-N
ID: 92095
SMILES:OC(c1c(CCCCCCC)cc2c(c1O)C1C(C(C)(C)O2)CCC(C)=C1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -16.738
InChIKey:KJTYRQLQSBKARF-UHFFFAOYSA-N
ID: 92096
SMILES:CCCCCc1cc2c(c(O)c1)C1C(CC(C)(C)C2)C(C)CC1c1ccccc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.611
CB1 binding score: -14.776
InChIKey:ZZZZNCYSLFUUSO-UHFFFAOYSA-N
ID: 92097
SMILES:O1c2cc(CCCCC)c(C=O)cc2C2CC(C)(C)CCC12C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -12.04
InChIKey:LLTSJABNJBHORA-UHFFFAOYSA-N
ID: 92098
SMILES:OC1C2(C)c3c(c(C#C)c(CCCCC)cc3O)OC(C)(C)C2CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -15.08
InChIKey:ANKTUKNRERLETE-UHFFFAOYSA-N
ID: 92099
SMILES:C1C2C3C(C(C)C)CCC2(C)Oc2c(c(O)cc(C(C)C(CC)OC(C)=O)c2OC3(C)C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.639
CB1 binding score: -15.065
InChIKey:KBAFASQAYGQCRH-UHFFFAOYSA-N
ID: 92100
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1(O)CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.016
InChIKey:DYJVRFKTUHQJIG-UHFFFAOYSA-N
ID: 92101
SMILES:c1(O)c(CC=C(C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -20.5
InChIKey:YVUPWYODRDEDFU-UHFFFAOYSA-N
ID: 92102
SMILES:c1cc(O)c2c(c1)-c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.555
CB1 binding score: -14.115
InChIKey:GMMLAWMHDKNHOH-UHFFFAOYSA-N
ID: 92103
SMILES:c1(O)c2c(ccc1CC)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -16.491
InChIKey:LCSJCNISBQAKEI-UHFFFAOYSA-N
ID: 92104
SMILES:c1c2c3c(cc(CCCCC)cc3O)OC(C)(C)C(O)(CCC2=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.723
InChIKey:XBBKYEMFNMDVIQ-UHFFFAOYSA-N
ID: 92105
SMILES:C(CCCc1cc2c(c(O)c1)C1C=C(C=O)CCC1C(C)(C)O2)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -14.913
InChIKey:IDGXOBNWKOIKKE-UHFFFAOYSA-N
ID: 92106
SMILES:OC(=O)C1=Cc2c(O)cc(CCCCC)cc2OC1(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.359
CB1 binding score: -16.894
InChIKey:SGYONNDTSDWYSW-UHFFFAOYSA-N