ID: 64156
SMILES:O(C(=O)C)c1c2c(c(COC(C(CC)C)=O)c(CC(C)C)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.623
CB1 binding score: -11.137
InChIKey:XVLKQLRMKMPZOY-UHFFFAOYSA-N
ID: 64157
SMILES:c1(CCCCC)c(C)c(C(O)=O)c(O)c2c1OC(C)(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.402
CB1 binding score: -16.863
InChIKey:LJEGMCBWRPQBBI-UHFFFAOYSA-N
ID: 64158
SMILES:C1(C(=C)C)C(c2c(O)cc(CCCCC)cc2O)CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.129
InChIKey:ZTGXAWYVTLUPDT-UHFFFAOYSA-N
ID: 64159
SMILES:C1=C(C)CCC([CH](C)CCC=C(C)C)C1c1c(O)cc(CCCCC)c(OC)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.63
CB1 binding score: -15.992
InChIKey:MAWAGGUHODDYQZ-UHFFFAOYSA-N
ID: 64160
SMILES:C(CCc1cc2c(c(O)c1)C1C(CCC(=C)C1C)(C)C(C)O2)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -17.28
InChIKey:SALXQAQQCDPJSE-UHFFFAOYSA-N
ID: 64161
SMILES:C1(C)=CC2(CC3C)CC(C13)C(CCC)C=C2c1c(O)c(C(=O)O)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.608
CB1 binding score: -14.949
InChIKey:ZKAKTHIUEYAZID-UHFFFAOYSA-N
ID: 64162
SMILES:c1c2c(cc(CCCCC)c1)OC(C)(C)c1c-2cc(C)c(Br)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 373.334
CB1 binding score: -15.288
InChIKey:DTFWYKCOXCQPTH-UHFFFAOYSA-N
ID: 64163
SMILES:c1(CCCCC)cc2c(c(OC)c1)C1C(CCC(COC(=O)C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -17.577
InChIKey:AHQPABPKXKUGCW-UHFFFAOYSA-N
ID: 64164
SMILES:C1C(=O)C(C)CCC2C(C)(C)Oc3cc(CCCCC)c(C(OC(C)=O)C(C)C)c(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.639
CB1 binding score: -14.334
InChIKey:OJIUXFJYLRZUHL-UHFFFAOYSA-N
ID: 64165
SMILES:C1(O)C(C)=CC2c3c(cc(CCOC)c(C=O)c3O)OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.423
CB1 binding score: -13.477
InChIKey:AIBRSSKNEDSUIZ-UHFFFAOYSA-N
ID: 64166
SMILES:C(CCCCc1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -18.609
InChIKey:HAKUWGCTBUVNJQ-UHFFFAOYSA-N
ID: 64167
SMILES:C1C2(C3C(C1O)C1C(CC(C)C1)O3)Oc1c(c(O)cc(CCC)c1)C2C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -12.671
InChIKey:SYPKYEKNIBTHID-UHFFFAOYSA-N
ID: 64168
SMILES:O=Cc1c(CCCCC)c(C(=O)Oc2c(C)cc(OI)c(C(C)C)c2)c(O)c2c1OC(CCC=C(C)C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 728.708
CB1 binding score: -15.133
InChIKey:OZXRRERLDSEUMF-UHFFFAOYSA-N
ID: 64169
SMILES:COc1cc(CCCCC)cc(OC)c1C1C=C(C)CCC1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -17.878
InChIKey:UYBGHBAVRNATET-UHFFFAOYSA-N
ID: 64170
SMILES:CC1C(O)C2C(=CC1)C(C)(C)Oc1c2cc(OC(=O)C)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -15.009
InChIKey:ZYDLSWGJMYIAPJ-UHFFFAOYSA-N
ID: 64171
SMILES:O=Cc1c(O)c2c(cc1CCCCC)OC(C)(C)C1CCC(C)(O)C(O)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -16.849
InChIKey:XGXJYFATYDKSLX-UHFFFAOYSA-N
ID: 64172
SMILES:C(C1=CC(c2ccc(CCCCC)cc2)C(C(=C)C)CC1)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -15.769
InChIKey:VKDOGISFKRDKPL-UHFFFAOYSA-N
ID: 64173
SMILES:c1(CCCCC)cc2c(c(O)c1)OC(C)(C)C1CC(O)C(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.747
InChIKey:GZXQAMTZYAIVIP-UHFFFAOYSA-N
ID: 64174
SMILES:c1(O)c(C2C=C(C)CCC2C(C)=C)c(O)c(C(=O)CC)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -17.388
InChIKey:PSPTVNSAYJUEGJ-UHFFFAOYSA-N
ID: 64175
SMILES:c1(CCCCC)cc2c(c(O)c1)C1CC(C)(CCC1C(C)=C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.198
InChIKey:NUXUDGMVYZUFNQ-UHFFFAOYSA-N
ID: 64176
SMILES:O(C)c1c2c(c(O)cc1)OC(C)(C)C1CCC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.044
InChIKey:GUYFDVCWQNSRBM-UHFFFAOYSA-N