ID: 94165
SMILES:Oc1c(C2C=C(C)CCC2C(=C)C)c(O)cc(CCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N
ID: 94166
SMILES:C12C(C)(CC(=O)CC1(C)C)C(C(=CC(=O)C)C)Oc1c2c(O)cc(CCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -14.805
InChIKey:VEOOXQPRGSSUED-UHFFFAOYSA-N
ID: 94167
SMILES:C1C(C)CC(c2c(O)cc(CCCCC)cc2O)OC1C=C(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -16.478
InChIKey:FJQYJKXQVLFMKV-UHFFFAOYSA-N
ID: 94168
SMILES:c1(CCCCC)cc(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 94169
SMILES:C(C=C(C)C)Cc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -17.689
InChIKey:WNPKXZGXEILAIQ-UHFFFAOYSA-N
ID: 94170
SMILES:Oc1c(C2C(C(C)(CO)O)CC=C(C)C2CC2OC2(C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.601
CB1 binding score: -15.517
InChIKey:UPOPVLPDEUAPPL-UHFFFAOYSA-N
ID: 94171
SMILES:C1(C=C(C)CCC=C(C)C)Oc2c(c(OC)cc(CCCC)c2)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -14.44
InChIKey:NXJRKNXGNUSTEY-UHFFFAOYSA-N
ID: 94172
SMILES:O(C(C1=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12)=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.943
InChIKey:CCMWHLPOQSRJEP-UHFFFAOYSA-N
ID: 94173
SMILES:O(c1cc(C2C=C(C)CCC2C(=C)C)c(O)cc1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.401
InChIKey:YRXZLRWBEYIBHE-UHFFFAOYSA-N
ID: 94174
SMILES:CC1=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CCC(C)=CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -19.032
InChIKey:NJSZRBFBYZMAGU-UHFFFAOYSA-N
ID: 94175
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C3CC(C)(CCC12)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.62
InChIKey:BWWZEXNZQQDWCR-UHFFFAOYSA-N
ID: 94176
SMILES:c1(CCC)cc(O)c(CC=C(C)CCC=C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -19.824
InChIKey:YJYIDZLGVYOPGU-UHFFFAOYSA-N
ID: 94177
SMILES:C(C)(C)=CC1CC(C)=CCOc2cc(CCCCC)c(C(=O)O)c(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -16.461
InChIKey:IGMLNJDGJHIMKP-UHFFFAOYSA-N
ID: 94178
SMILES:C1(C)C2(C)Oc3c(c(O)cc(CCCCCC)c3)C3C=C(C(=O)O)C(CC12)O3
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -15.95
InChIKey:BPAYWNUYSDVQSO-UHFFFAOYSA-N
ID: 94179
SMILES:c12c(c(O)cc(CCCCC)c1)-c1c(ccc(C(O)=O)c1)OC2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.419
CB1 binding score: -16.015
InChIKey:VIWMNLXAUJGKAW-UHFFFAOYSA-N
ID: 94180
SMILES:c1(C(CC(C)C)=O)c(O)c(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.393
InChIKey:YLSNMWZGJJCLRT-UHFFFAOYSA-N
ID: 94181
SMILES:C1(C)CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 94182
SMILES:C1C(O)C(C)=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.584
InChIKey:RYHLMVNVCCCRHW-UHFFFAOYSA-N
ID: 94183
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2C3OC3(CCC=C(C)COC(=O)C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.596
CB1 binding score: -15.168
InChIKey:GIFSFZUSEBALBN-UHFFFAOYSA-N
ID: 94184
SMILES:C1(O)CCC2(C)Oc3c(c(O)cc(CCCCC)c3)C3=C2CC1(C)C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.035
InChIKey:DJMQTORRBYPRMD-UHFFFAOYSA-N
ID: 94185
SMILES:C(C(c1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)(O)CC1)C)CC(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Bisabolane sesquiterpenoids;Cannabinoids
MW: 360.538
CB1 binding score: -14.824
InChIKey:AGCGERWMHCQTLW-UHFFFAOYSA-N