ID: 112162
SMILES:Oc1c(C2C(C(=C)C)CCC(C)=C2)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 112163
SMILES:CC1(C)OC(C)=CCC1C(C)c1cc(O)c(C)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -15.749
InChIKey:CHDNOQZRZXFYTQ-UHFFFAOYSA-N
ID: 112164
SMILES:C1C=C(C(O)=O)CCC12c1c(cc(CCCCC)cc1O)OC(C)(C)C2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -14.544
InChIKey:RUDLAPWCAFFQCI-UHFFFAOYSA-N
ID: 112165
SMILES:C1(O)CC(C(C)=C)C(c2c(CC(=O)C)c(O)c(C)c(O)c2)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -16.259
InChIKey:LQESGPGZXDNVKH-UHFFFAOYSA-N
ID: 112166
SMILES:C1CC(C(C)=C)C(c2c(O)cc(CCCC)cc2O)CC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -17.384
InChIKey:UUSBGEURXRLGQE-UHFFFAOYSA-N
ID: 112167
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 112168
SMILES:C(CCC)c1cc(O)c2c(c1)OC1(C(O)C(C(C)C)CCC1C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -15.657
InChIKey:ZUFQTNMRFUVOFR-UHFFFAOYSA-N
ID: 112169
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)c1ccc(C)cc1-2)CC(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.447
CB1 binding score: -15.379
InChIKey:GLAVRPRXYUYPFY-UHFFFAOYSA-N
ID: 112170
SMILES:C1(O)C(=O)C(COC)=CC2=C1C(C)(C)Oc1cc(CCCCC)cc(O)c1-2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.461
CB1 binding score: -13.884
InChIKey:UWDLRAQKYBKYBM-UHFFFAOYSA-N
ID: 112171
SMILES:C12(C)c3c(cc(C)c(OC4=C(C)C(=O)C(O)(C(C)(C)C)C(=C)C4)c3O)OC(C)(C)C1CCC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.607
CB1 binding score: -14.301
InChIKey:LUSORCUJOHZWGY-UHFFFAOYSA-N
ID: 112172
SMILES:O=C1C(C)=CC2c3c(cc(CCCCC)cc3O)OC(C1)C2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.739
InChIKey:ZLBRWBHEXYXOQP-UHFFFAOYSA-N
ID: 112173
SMILES:CC(C)=CCCc1c(O)cc(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.393
CB1 binding score: -17.493
InChIKey:BFPXFAHDYHTBOO-UHFFFAOYSA-N
ID: 112174
SMILES:CCCc1cc(O)c2c(c1)OC1C2C(C)(C)CCC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -15.936
InChIKey:PCPUYFRDGOVRKK-UHFFFAOYSA-N
ID: 112175
SMILES:C(C)(c1cc(O)c2c(c1)OC(C)(C)C1C2C(C=O)CC1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -14.052
InChIKey:RQKMFCRAUVXTRH-UHFFFAOYSA-N
ID: 112176
SMILES:c1c(CCCCC)cc2c(c1O)C=CC(C)(CCC=C(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 112177
SMILES:C12C(c3c(cc(CCC)cc3O)OC1C=C(CCC=C(C)C)C)CC(C)=CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -15.04
InChIKey:SBVSWDRQLYRTKU-UHFFFAOYSA-N
ID: 112178
SMILES:CC(C1CCC(C)(O)C2Oc3c(c(O)cc(CCCCC)c3)C12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -18.961
InChIKey:CNKSTABSFLNANJ-UHFFFAOYSA-N
ID: 112179
SMILES:C(c1c2c3c(c(O)c1)C(C)CCC3C(C)(C)O2)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -17.359
InChIKey:LSFYUXSCNHMASK-UHFFFAOYSA-N
ID: 112180
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2(CC=C(CCC=C(C)C)C)C1Oc1ccc(cc1)CC(=O)C(C)=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 514.706
CB1 binding score: -16.134
InChIKey:TWRIWIWNNVMMKY-UHFFFAOYSA-N
ID: 112181
SMILES:C(Cc1cc(O)c(CC=C(CCC=C(CCC=C(C(O)=O)C)C)C)c(OC)c1)c1ccc(O)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 494.628
CB1 binding score: -15.461
InChIKey:ZEDSJCKICUITAD-UHFFFAOYSA-N
ID: 112182
SMILES:O(c1c(C(C)C)c(C(O)=O)c(O)c2c1OC(C)(C)C1C2C=C(C)CC1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -14.421
InChIKey:MILAKNAFWNVXTN-UHFFFAOYSA-N