ID: 62938
SMILES:BrC1C(C)(C)Oc2c(c(O)cc(CCCCC)c2)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 343.261
CB1 binding score: -17.061
InChIKey:CINLPKDSTQJRTO-UHFFFAOYSA-N
ID: 62939
SMILES:C1(C)C=C(C)C2(OO)C1C(C)(C)Oc1c(cc(O)cc1C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -14.615
InChIKey:FCNCJTOBUSRZCU-UHFFFAOYSA-N
ID: 62940
SMILES:C=C1CCC2C(c3c(cc(CCCCC)c(O)c3O)OC2(C)C)C(C)(C)C1CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.668
CB1 binding score: -17.029
InChIKey:BYRMLYLVVTZKPI-UHFFFAOYSA-N
ID: 62941
SMILES:C1C(C)=C(C)C(C)(c2c(O)cc(CCCCC)cc2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.432
CB1 binding score: -16.502
InChIKey:PHNLYUHACAHXIF-UHFFFAOYSA-N
ID: 62942
SMILES:C1(O)C(C(C)(CCCC(C)(O)C)O)Oc2c(c(O)c(C(=O)CCCCC)c(CCCCC)c2)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 478.67
CB1 binding score: -16.137
InChIKey:ODTWRPLDFDKKBY-UHFFFAOYSA-N
ID: 62943
SMILES:Oc1c(C=CC(C)(C)O)c(-c2ccc(O)cc2)c(OC)c(O)c1C1C=C(C)CCC1C(=C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.575
CB1 binding score: -10.953
InChIKey:BIOAGQPPTVPPCG-UHFFFAOYSA-N
ID: 62944
SMILES:C=C(C1C(c2c(O)cc(CCCC)cc2O)CC(C)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -17.384
InChIKey:UUSBGEURXRLGQE-UHFFFAOYSA-N
ID: 62945
SMILES:C1C(C(C)(C)O)Oc2c(c(O)cc(CCC)c2)C1C=CC(OC)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -14.918
InChIKey:VREOOWSUBITUDH-UHFFFAOYSA-N
ID: 62946
SMILES:C(=O)(CO)c1c2c(cc(C)c1CCCl)OC(C)(C)C1(C2)Oc2c(ccc(C)c2)C(C)(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.982
CB1 binding score: -16.062
InChIKey:ALNRONBCJDDINZ-UHFFFAOYSA-N
ID: 62947
SMILES:O(C)c1c(OC)c2c(cc1CCCCC)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -18.752
InChIKey:RHEHYVZUEHYPRN-UHFFFAOYSA-N
ID: 62948
SMILES:C1(C(=O)C)CCC(C)C(c2c(O)cc(CCCCC)cc2)C1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -14.793
InChIKey:AUWQPXTZLMVIAM-UHFFFAOYSA-N
ID: 62949
SMILES:C=C(C1CCC(C)=CC1c1cc(CCCCC)cc(O)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -19.107
InChIKey:AKCTZOKCVCWTGX-UHFFFAOYSA-N
ID: 62950
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1C2C(OC)C(C)(O)C1O)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -15.239
InChIKey:JWMBTJQSZHNIDJ-UHFFFAOYSA-N
ID: 62951
SMILES:C12c3c(cc(O)cc3)OC(C)(C)C1CCC(C)=CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -17.199
InChIKey:DFOTXYJHCLPBBO-UHFFFAOYSA-N
ID: 62952
SMILES:O1C(C)(C)C2CCC(C)=CC2c2c1cc(C)cc2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -20.957
InChIKey:WIDIPARNVYRVNW-UHFFFAOYSA-N
ID: 62953
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C(C)(C)C1(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -17.312
InChIKey:JSPSTQNGVIMTKB-UHFFFAOYSA-N
ID: 62954
SMILES:O(c1cc(CCCCC)cc(O)c1CC=C(C)CCC=C(C)C)C=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.576
InChIKey:CJUGVJKECMOMGS-UHFFFAOYSA-N
ID: 62955
SMILES:C1(C(=C)C)CCC(C)=CC1c1c(O)cc(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N
ID: 62956
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C1CC=C(CO)C(O)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -18.401
InChIKey:IQFBDTWPFXQKNC-UHFFFAOYSA-N
ID: 62957
SMILES:c1c(CCCCC)cc2c(c1O)-c1c(cccc1)OC2(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.41
CB1 binding score: -16.266
InChIKey:JLWLLKZBTDMNQX-UHFFFAOYSA-N
ID: 62958
SMILES:c1c2c(cc(CCCCC)c1)OC(C)(C)C1C2CC(C)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -16.665
InChIKey:CORVPMJJSJMCQG-UHFFFAOYSA-N