ID: 62014
SMILES:C(CC(C)=CCc1c(OC)c(CCCCC)cc(O)c1)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -16.939
InChIKey:LOXIJZODUCQESR-UHFFFAOYSA-N
ID: 62015
SMILES:C1(C)(C)CC(O)C2(O)Cc3c(O)cc(C)cc3OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: -18.157
InChIKey:KQWBBLASKWHNPS-UHFFFAOYSA-N
ID: 62016
SMILES:c1(C)cc2c(c3c1CC(OC(C)=O)O3)OC(C)(C)C1CCC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -13.58
InChIKey:IXEWLEPLZGCJPY-UHFFFAOYSA-N
ID: 62017
SMILES:C1(c2c(O)cc(CCCCC)cc2O)(C)CCC(C(O)(C)C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 322.445
CB1 binding score: -16.714
InChIKey:MHIUSPUNWRRFJF-UHFFFAOYSA-N
ID: 62018
SMILES:Oc1c(CC=C(C)CCC=C(C)C)c(O)ccc1CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.467
InChIKey:TVERKJMGSVKUPT-UHFFFAOYSA-N
ID: 62019
SMILES:C(C)(C)C1c2c(ccc(C)c2)-c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.464
CB1 binding score: -17.111
InChIKey:AGVGYSMDQFJPRR-UHFFFAOYSA-N
ID: 62020
SMILES:c12c(c(OC)cc(CCCCC)c1)C1C(C(C)(C)O2)C(C=C(CCC=C(C)C)C)OC2C1=C(C)C(=O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 508.699
CB1 binding score: -15.849
InChIKey:FITOLWPYJGLZQT-UHFFFAOYSA-N
ID: 62021
SMILES:C(CCC)Cc1cc(O)c(C2C=C(C(OC)CC=C(C)C)C(O)C(=O)C2C)c(CC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -15.736
InChIKey:PHKWFCQFRQDFIS-UHFFFAOYSA-N
ID: 62022
SMILES:c12cc(CCCCC)cc(O)c1C1C(CC=C(C)CCC=C(C)CCC2C(C)=C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.626
CB1 binding score: -15.439
InChIKey:BUONYKRQSBHAIK-UHFFFAOYSA-N
ID: 62023
SMILES:c1(C)ccc2c(c1)-c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 62024
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1C(C=C(C)CC1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.951
InChIKey:CSAQQDLBKSCGOR-UHFFFAOYSA-N
ID: 62025
SMILES:CC1=C(CCC(C)=CCc2c(O)c(C(=O)O)c(CCC)cc2O)C(C)(C)CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -16.477
InChIKey:GBOAFELGBJETOA-UHFFFAOYSA-N
ID: 62026
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1=CC2(C)CC1)C=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.426
CB1 binding score: -15.929
InChIKey:FQXAVVXQEJHMFW-UHFFFAOYSA-N
ID: 62027
SMILES:C1CC2(C(C)(C)O)Cc3c(c(C(O)=O)c(CCCCC)cc3O)OC2(C)C2OC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.503
CB1 binding score: -16.101
InChIKey:KGXOXCJSIGYJII-UHFFFAOYSA-N
ID: 62028
SMILES:C1C(C(C)C)=CCC2(C)CC3c4c(O)cc(CCCCC)cc4OC3(C)C=C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -14.146
InChIKey:XXBAEWWUMFBTHX-UHFFFAOYSA-N
ID: 62029
SMILES:C1(O)C2C(C)(Oc3c(c(OC)cc(CCCCC)c3)C2O)C=CC1C(C)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -19.154
InChIKey:CXEJHNCXXBSNSC-UHFFFAOYSA-N
ID: 62030
SMILES:C(CCCc1cc2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -18.354
InChIKey:OJTMRZHYTZMJKX-UHFFFAOYSA-N
ID: 62031
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C(C(C)(CCC=C(C)C)C2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.616
CB1 binding score: -17.346
InChIKey:HWVNDCSVCDZMBG-UHFFFAOYSA-N
ID: 62032
SMILES:c1(O)c(CC=C(C)C)c(O)c(C(=O)O)c(CCCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.375
CB1 binding score: -19.394
InChIKey:IQDBYPKRWVDTCI-UHFFFAOYSA-N
ID: 62033
SMILES:c1(CCCC)cc2c(c(O)c1)C1C(CCC(CO)=C1)(C)C(C)(O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -16.438
InChIKey:PNTNJYKRGFAWNS-UHFFFAOYSA-N
ID: 62034
SMILES:C12(Oc3c(c(O)cc(CCCCC)c3)C1)C(C)C(C)(O)OC2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.402
CB1 binding score: -16.401
InChIKey:OWUJJCYTVJVKKU-UHFFFAOYSA-N