ID: 59347
SMILES:C1C(C(C)C)C(c2c(O)c(CC=C(C)CCC=C(C)C)c(O)cc2)C=C(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -15.116
InChIKey:GZUPHMHLOCSVOG-UHFFFAOYSA-N
ID: 59348
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C(=O)O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 59349
SMILES:C1CC2(C)Oc3c(c(O)cc(CCC)c3)C2C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 232.323
CB1 binding score: -16.015
InChIKey:PEXJDQOFVCTVBI-UHFFFAOYSA-N
ID: 59350
SMILES:C(CCC)Cc1cc(O)c(C2C(C(CC(C)=O)C)CC(=O)O2)cc1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -16.229
InChIKey:CPKKJNRTGMZTKI-UHFFFAOYSA-N
ID: 59351
SMILES:C1C23c4c(cc(CCCCC)cc4OC2C(C)=CC1)OCO3
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -12.841
InChIKey:XIMWRLCXGADZOQ-UHFFFAOYSA-N
ID: 59352
SMILES:C1=C(C)CCC(C(=C)C)C1c1c(O)cc(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N
ID: 59353
SMILES:C1(C)(C)C2CC1C(C)=CC2c1c(O)ccc(CCCCC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -15.929
InChIKey:YPZXAFAHWRQGPW-UHFFFAOYSA-N
ID: 59354
SMILES:C12C(C)CC3C(C(C[N+]#C)C)CC=C(C)C3C1c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.606
CB1 binding score: -14.885
InChIKey:IESFWTIHFHUJBZ-UHFFFAOYSA-O
ID: 59355
SMILES:C1(C)(C)Oc2c(cc(O)c(C)c2)C2C=C(C(O)C)C(=O)CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Miscellaneous meroterpenoids
MW: 302.37
CB1 binding score: -16.323
InChIKey:MWPOYUJTZRNXMZ-UHFFFAOYSA-N
ID: 59356
SMILES:C(CCCC)c1c(O)c2c(cc1O)OC(C)(C)C1C2CC(C)=CC1OC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -14.896
InChIKey:PDSLOOIWTLWIDY-UHFFFAOYSA-N
ID: 59357
SMILES:CC(C)C(=O)c1c(O)c2c(cc1C)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.334
InChIKey:DANOCMQSDCIDGQ-UHFFFAOYSA-N
ID: 59358
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)-c2c(c(C)ccc2C(C)C)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -14.227
InChIKey:HVRAXFOWEDNXEI-UHFFFAOYSA-N
ID: 59359
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1)(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -16.879
InChIKey:CHHIBMGUMOSFCA-UHFFFAOYSA-N
ID: 59360
SMILES:C12c3c(cc(CCCCC)cc3O)OC(C(=C)C1)C2OC(C(=C)C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -15.109
InChIKey:PLTWSMYQFXXOSJ-UHFFFAOYSA-N
ID: 59361
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1CCC(C(O)=O)=CC12)CC=C(C)COC(C=Cc1ccccc1)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 502.607
CB1 binding score: -15.057
InChIKey:DYKLWKIZPFJPQT-UHFFFAOYSA-N
ID: 59362
SMILES:C(C)(C)=CCc1c(O)cc(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -20.5
InChIKey:YVUPWYODRDEDFU-UHFFFAOYSA-N
ID: 59363
SMILES:C1=C(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.875
InChIKey:MABLLFKQVKWWPG-UHFFFAOYSA-N
ID: 59364
SMILES:C1(CO)=CC(=O)c2c3c(ccc21)-c1c(cc(CCCCC)cc1O)OC3(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.468
CB1 binding score: -15.797
InChIKey:UMYUKMWAQMXXCZ-UHFFFAOYSA-N
ID: 59365
SMILES:C1C2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C(=CC=CC(C)(C)O)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -13.968
InChIKey:SUUALOLFYAVKCG-UHFFFAOYSA-N
ID: 59366
SMILES:C(C1(C)Oc2c(c(OC)cc(CCCCC)c2)C(O)C1)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -16.555
InChIKey:WAYQMZVOWSFJKM-UHFFFAOYSA-N
ID: 59367
SMILES:C1(C)=CCCC(Cc2c(O)c(C(=O)O)c(CCCCC)cc2O)C1C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -14.605
InChIKey:COSMEIOREPQPHU-UHFFFAOYSA-N