ID: 140890
SMILES:c1(O)c(C2C=C(C)CCC2C(=C)C)cc(C(OCC)=O)c(O)c1CC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -17.485
InChIKey:IVTLFCPBLIAJCR-UHFFFAOYSA-N
ID: 140891
SMILES:C1(C)(C)C2C=CC(C)(O)CC2c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.25
InChIKey:PGZISGZFEFJPOZ-UHFFFAOYSA-N
ID: 140892
SMILES:C1(C)=CC2c3c(O)cc(C)cc3OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -16.598
InChIKey:JVKYHOYRUXXSOQ-UHFFFAOYSA-N
ID: 140893
SMILES:c1(CC(C)C)cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.506
InChIKey:LCWPGHYENVNAJV-UHFFFAOYSA-N
ID: 140894
SMILES:C(C1=CC(c2c(O)cc(C)cc2O)C(C(=C)C)CC1)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -16.622
InChIKey:PIJYUMGPCWSVHB-UHFFFAOYSA-N
ID: 140895
SMILES:C12CC(C)=CCC1C(C)(C)Oc1c(OC)cc(O)c(CC=C(C)C)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.306
InChIKey:XQQPKPRCNKIULG-UHFFFAOYSA-N
ID: 140896
SMILES:Oc1cc(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: 140897
SMILES:C(CC1=CCC(C(=O)CCC(C)=CCc2cc(O)c(CC(C)C)cc2O)O1)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -15.706
InChIKey:KYABRAIBZTXSFT-UHFFFAOYSA-N
ID: 140898
SMILES:Oc1c(C2C(C(=C)C)C(c3ccc(CCCC(O)C)cc3OC(C)=C2)C(OC)=O)cc(O)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.574
CB1 binding score: -13.99
InChIKey:ZGFNCZYQNCDITC-UHFFFAOYSA-N
ID: 140899
SMILES:C(=CCc1c(O)cc2c(c1)OC(C)(C)C1C2CC(C)C=C1)C(C)(C)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -12.851
InChIKey:QTYQMGMTFUMXNJ-UHFFFAOYSA-N
ID: 140900
SMILES:c1(CCC(=O)C)cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -17.64
InChIKey:NLNTYNQQFDNDTM-UHFFFAOYSA-N
ID: 140901
SMILES:C(CCCc1cc(O)c2c(c1)OC(C)(C)C1C2C(C(O)=O)CC1)C(O)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.422
CB1 binding score: -14.435
InChIKey:NTMUNTVMZHOIAU-UHFFFAOYSA-N
ID: 140902
SMILES:C1(C)(C)C2CC(O)C(C)=CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.534
InChIKey:INKUWBOHCFHXTJ-UHFFFAOYSA-N
ID: 140903
SMILES:O(C1CC(C)=CC2c3c(OC(C)=O)c(OC(=O)C)c(CCCCC)cc3OC(C)(C)C1C2)C1C(O)C(O)C(O)C(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 590.71
CB1 binding score: -15.374
InChIKey:FXGYSFMGMGYUJG-UHFFFAOYSA-N
ID: 140904
SMILES:C1C2C(O)(CC(C)(C)C2)C(C)(O)c2c1cc(CCCCC)cc2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -16.55
InChIKey:JWHFOTURJOKAAA-UHFFFAOYSA-N
ID: 140905
SMILES:C1(C)(C)Oc2cc(CCCCC)cc(OC)c2C2C=C(CCC=C(C)[CH]CC1O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 411.606
CB1 binding score: -13.307
InChIKey:AYOLZVMLFBTWLE-UHFFFAOYSA-N
ID: 140906
SMILES:C1(C)(C)Oc2cc(CCCCC)cc(O)c2C2C1CCC(C(=O)CCC(C)=CC(OC)=O)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.607
CB1 binding score: -16.438
InChIKey:SEZCVGGFRSGMQO-UHFFFAOYSA-N
ID: 140907
SMILES:C12c3c(O)cc(CCCCC)cc3OC(C)(C)C1CCC(C=C)(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -17.091
InChIKey:BIDZRSZOKJXNBO-UHFFFAOYSA-N
ID: 140908
SMILES:c1(O)c(CC=C(C)C)cc(O)cc1CC=C(C)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.748
InChIKey:VRXKPPYOGGSRFK-UHFFFAOYSA-N
ID: 140909
SMILES:C12C(C)(CBr)Oc3c(c(O)c(C(=O)Oc4ccc(CCCCC)cc4)c(CC=C)c3)CC1CCC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 555.553
CB1 binding score: -14.648
InChIKey:PSOYIRYMJZRVTC-UHFFFAOYSA-N
ID: 140910
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2(O)C1CC(O)C(C)(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.482
CB1 binding score: -15.526
InChIKey:KXUKEHHFUNIULI-UHFFFAOYSA-N