ID: 26839
SMILES:C(CC)CCCc1cc(O)c(C2C=C(C(O)=O)CCC2C(C)C)cc1C=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 372.505
CB1 binding score: -13.612
InChIKey:JQXDIUDFAPFCMP-UHFFFAOYSA-N
ID: 26840
SMILES:CC1=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 26841
SMILES:CC(=O)Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(C)(OC(C)=O)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -15.716
InChIKey:IQYVFEKHZCYZQC-UHFFFAOYSA-N
ID: 26842
SMILES:c1c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.189
InChIKey:AIOSXAOKGBOYPS-UHFFFAOYSA-N
ID: 26843
SMILES:C(C=C(C)C)CC1(C)C=CCC2(C)Oc3cc(CCCCC)cc(O)c3C3C12OO3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -15.009
InChIKey:RUUGNXGMQJRIFX-UHFFFAOYSA-N
ID: 26844
SMILES:C1C2(C)OC3=C(C(=O)C=C(CO)C3=O)CC2C(C)(CC=CC(C)(O)C)C(Br)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 453.373
CB1 binding score: -14.793
InChIKey:RURDCMURFIHVIH-UHFFFAOYSA-N
ID: 26845
SMILES:C(CC)CCCc1cc2c(c(O)c1)C1CC(C(O)=O)CCC1C2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.088
InChIKey:LMFMICQEZVSDFH-UHFFFAOYSA-N
ID: 26846
SMILES:c1(O)cc(CCCCC)cc2c1-c1cc(CCC(OCC)=O)cc3c1C(C(C)(C)O3)OC2C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.591
CB1 binding score: -17.606
InChIKey:GNYJRIKNBADUFP-UHFFFAOYSA-N
ID: 26847
SMILES:c1(CC2CC=C(C)C(CCC(C=C)(O)C)O2)c(O)c(C)cc(OC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -12.896
InChIKey:URZMDLWUBCNEKH-UHFFFAOYSA-N
ID: 26848
SMILES:Oc1cc2c(c(O)c1C)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -16.335
InChIKey:OANRDWLZYAFXPK-UHFFFAOYSA-N
ID: 26849
SMILES:CC(=CCc1c(O)cc(CCc2ccc(O)cc2)cc1O)CCC=C(CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.62
CB1 binding score: -19.427
InChIKey:VVBVATXKSUVSTB-UHFFFAOYSA-N
ID: 26850
SMILES:C(C)C(CCCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(CO)=C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -15.33
InChIKey:ZQEBWPVYSTXDPU-UHFFFAOYSA-N
ID: 26851
SMILES:CC(=CC(=O)Oc1cc(CCCCC)cc(O)c1C1C(C(C)C)CCC(C)=C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -13.93
InChIKey:QCBYXLFOHGNIQZ-UHFFFAOYSA-N
ID: 26852
SMILES:COc1c2c(cc(C(O)CCCC)c1)OC1(C)CC2C(C)(C)OC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -14.897
InChIKey:BAMZHKXWMGDECB-UHFFFAOYSA-N
ID: 26853
SMILES:CC1C2Cc3c(O)c(C(=O)O)c(CCCCC)cc3OC2(C)CCC1C(C)(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.547
CB1 binding score: -15.767
InChIKey:QYHYSIYIIHUBBA-UHFFFAOYSA-N
ID: 26854
SMILES:C(C=C(C)C)CC1(C)c2c(c(=O)c(C(=O)OC)c(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -14.384
InChIKey:XILKTDSVGMLGIR-UHFFFAOYSA-N
ID: 26855
SMILES:CC(C)C1C=CC(C)=CC1c1c(O)cc(CCC)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -17.071
InChIKey:NDVXZRRNGQAYLM-UHFFFAOYSA-N
ID: 26856
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.487
CB1 binding score: -19.108
InChIKey:KCGRQTUOQYSEJY-UHFFFAOYSA-N
ID: 26857
SMILES:C1(C(C)C)C2c3c(c(O)c(C(=O)O)c(CCCCC)c3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -13.736
InChIKey:RXSULFZGVQRFPI-UHFFFAOYSA-N
ID: 26858
SMILES:C(C)(=CCO)C1OC(CC2(C)C=Cc3c(c(C)cc(OC)c3)O2)C1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -14.47
InChIKey:FZQXCOAFKJDQPX-UHFFFAOYSA-N
ID: 26859
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1C1C(C)(CC2)C(O)CCC1=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -15.093
InChIKey:CKYQIECRUPHEKV-UHFFFAOYSA-N