ID: 129949
SMILES:C1C(C)=CC(c2c(O)cc(CCCCC)cc2)C(C(C)(O)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.257
InChIKey:KETCUGMUWAEENN-UHFFFAOYSA-N
ID: 129950
SMILES:CCCc1ccc(O)c2c1OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -17.344
InChIKey:RXYCDODJCOZUAU-UHFFFAOYSA-N
ID: 129951
SMILES:c1(O)[n+]c(C)c(O)cc1C1C(C(C)=C)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 259.349
CB1 binding score: -13.522
InChIKey:UZVJLJXNNIGRSY-UHFFFAOYSA-N
ID: 129952
SMILES:Oc1c(C(C)C(C)CC)c2c(cc1C)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.598
CB1 binding score: -12.594
InChIKey:IAVJAWLEJHGTQM-UHFFFAOYSA-N
ID: 129953
SMILES:CC1(C)C2C=C(C)CCC21c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -13.325
InChIKey:HAEFZEAFHQGHGY-UHFFFAOYSA-N
ID: 129954
SMILES:Oc1c2c(cc(CCCCC)c1)OC(CO)(C)C2=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.321
CB1 binding score: -17.3
InChIKey:HVFXXDZHZANIOF-UHFFFAOYSA-N
ID: 129955
SMILES:c1(O)c(C)c(C2C(C(C)=C)CCC(C)=C2)c(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -20.404
InChIKey:VXQQRDHPGZTKOG-UHFFFAOYSA-N
ID: 129956
SMILES:C1(C)(C)C(O)C2c3c(O)cc(CCCCCC)cc3OC2(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -15.116
InChIKey:JTPNYSRLSQISDM-UHFFFAOYSA-N
ID: 129957
SMILES:c12c(cccc1O)OC(C)(C)C1C2C=C(C)CC1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -16.013
InChIKey:AZLYFBZGTFYTHV-UHFFFAOYSA-N
ID: 129958
SMILES:Cc1c(=O)c(O)cc2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -15.929
InChIKey:MJJFBWVYGOXJSO-UHFFFAOYSA-N
ID: 129959
SMILES:C(C)CCCc1cc(O)c(C2C=C(C)CCC2C(C)=C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.957
InChIKey:OANGEIYPAQYPQV-UHFFFAOYSA-N
ID: 129960
SMILES:c1(OCC=C(C)CCC=C(C)C)c(OC)cc(CC2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.625
CB1 binding score: -16.563
InChIKey:QBBBXCOYHSKYMM-UHFFFAOYSA-N
ID: 129961
SMILES:c1(C(O)(C)C)cc(O)c2c(c1)OC1(C)CCC(C(=C)C)=C1C2O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -13.507
InChIKey:OREQIJIDMYTWNX-UHFFFAOYSA-N
ID: 129962
SMILES:C12C(C(C)(C)Oc3cc(CCCCC)cc(O)c31)CC(C)C(O)C=C(C(C)C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.63
CB1 binding score: -16.74
InChIKey:ZKYAKEUBINBAQM-UHFFFAOYSA-N
ID: 129963
SMILES:c1c(C(C)C)ccc2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 270.416
CB1 binding score: -17.979
InChIKey:ZLPGXSHLPLOFQK-UHFFFAOYSA-N
ID: 129964
SMILES:C(CCCC)c1cc(OC)c(O)c2c1OC1(C)C(O)CC(C(C)=C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -17.121
InChIKey:HCOGLQCIBNKNGD-UHFFFAOYSA-N
ID: 129965
SMILES:Oc1cc(CCCCC)cc(O)c1C1C=C(C)CCC1C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -19.572
InChIKey:KKASRYPDNSSAPZ-UHFFFAOYSA-N
ID: 129966
SMILES:C1(C)=CC2C(C(C)(C)Oc3occc32)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 218.296
CB1 binding score: -17.792
InChIKey:KRPULEPNRXMWAF-UHFFFAOYSA-N
ID: 129967
SMILES:C(=C)(C)C12C(C=C(C)CC1)Cc1c(OC)cc(CCCCC)cc1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -16.283
InChIKey:QABGOCOJHLMTOJ-UHFFFAOYSA-N
ID: 129968
SMILES:C1(=O)C2(C(C)=C)C3(CC(C)(C)CC13)Oc1c2c(OC)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: Not available
InChIKey:JZZAWKPSNRQPMP-UHFFFAOYSA-N
ID: 129969
SMILES:c1(COC(=O)C(C)C)cc(OC)c(C2C(C(=C)C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.474
InChIKey:JULMMQKYJOAFHM-UHFFFAOYSA-N