ID: 45844
SMILES:CC1=CC(c2c(O)cc(CCCCC)cc2)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.957
InChIKey:OANGEIYPAQYPQV-UHFFFAOYSA-N
ID: 45845
SMILES:O(c1ccc(C)c(C(=O)OCC2CC(C=C(C)C)Oc3cc(CCCCC)c(OC(=O)C)cc32)c1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 494.628
CB1 binding score: -14.049
InChIKey:TUFLDMZTPALFNQ-UHFFFAOYSA-N
ID: 45846
SMILES:C1(C)=CCCC(=C)C2C(C1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -17.627
InChIKey:MXIYYPQTXLLADH-UHFFFAOYSA-N
ID: 45847
SMILES:C1(C(C)=C)=Cc2ccc(CCCCC)cc2OC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -14.685
InChIKey:AHVBQFSSWDVMSM-UHFFFAOYSA-N
ID: 45848
SMILES:O1c2c(c(O)cc(C(CCCCCCC)=O)c2)C2C(CCC(=C)C2)C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -14.791
InChIKey:SRJORTVLTOVXHG-UHFFFAOYSA-N
ID: 45849
SMILES:C1CC(C)=CC2C1C(C)(C)Oc1c2nc(CCc2cc(O)ccc2)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 365.473
CB1 binding score: -11.658
InChIKey:XJXLSAASQINZOD-UHFFFAOYSA-N
ID: 45850
SMILES:c1(OC)cc(CCCC)cc2c1OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.144
InChIKey:MIOSEPHWQQFWCX-UHFFFAOYSA-N
ID: 45851
SMILES:CC(C)C1=CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.875
InChIKey:MABLLFKQVKWWPG-UHFFFAOYSA-N
ID: 45852
SMILES:C1CC12C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -17.388
InChIKey:RKXZJLJFMSUGNO-UHFFFAOYSA-N
ID: 45853
SMILES:C1(Cc2ccccc2)=CC(C)C(CCC(CCC)C)Cc2cc(OC)c3c(c21)OC(C)(C)C1C3C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 526.805
CB1 binding score: -15.397
InChIKey:BGTVCNMIFZDNJI-UHFFFAOYSA-N
ID: 45854
SMILES:C(C)(=C)C1C(c2c(O)cc(CCC)cc2O)C(C(=C)C)CC1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -12.769
InChIKey:RWFOJGHZOPVZBK-UHFFFAOYSA-N
ID: 45855
SMILES:Oc1c(CC2C(=C)CC=CC2(C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.864
InChIKey:RFCUIGLGAUWUME-UHFFFAOYSA-N
ID: 45856
SMILES:c1(O)c(CCCC)c(O)c2c(c1C=O)OC(C)(C)C1C2CC(C)=CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -15.306
InChIKey:YLMCSYWTQBCIMX-UHFFFAOYSA-N
ID: 45857
SMILES:Oc1c2c(cc(CCCCC)c1)C(CC1C(C(=O)OC)CCC(CCCCC)C1)OCO2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.628
CB1 binding score: -12.907
InChIKey:BSQXGSMGFRWTHM-UHFFFAOYSA-N
ID: 45858
SMILES:c1cc(O)cc2c1OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -19.07
InChIKey:LIEZPCZOEMYUIR-UHFFFAOYSA-N
ID: 45859
SMILES:O=C1c2c(cc(CCCCC)cc2O)OC(C)(C)C(O)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.375
CB1 binding score: -16.7
InChIKey:AYBQUQJLBIGMML-UHFFFAOYSA-N
ID: 45860
SMILES:C(CCCCc1cc2c(c(O)c1)C1C(C(C)C)CCC(C)(O2)C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -16.393
InChIKey:NGTPJAMOWNUXOS-UHFFFAOYSA-N
ID: 45861
SMILES:CC(C(=O)C(C)C)(O)c1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.276
InChIKey:XFXGBOJKFPHDOL-UHFFFAOYSA-N
ID: 45862
SMILES:CC1=CC2C(C(C)(C)Oc3c(C(C(O)C)=O)ccc(O)c32)CC=C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -15.609
InChIKey:HKGUBEVLXNMHTR-UHFFFAOYSA-N
ID: 45863
SMILES:c1(C2C(C(C)C)CCC(C)C2)cc(CCCCC)ccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.503
CB1 binding score: -18.434
InChIKey:FHTXWJYHYWKJKG-UHFFFAOYSA-N
ID: 45864
SMILES:C(Cc1cc(O)c(C2C(C(CO)C)CCC(C)=C2)c(O)c1)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.483
InChIKey:NOBVLNKOMCEFJL-UHFFFAOYSA-N