ID: 113002
SMILES:C1(C)=CC2c3c(cc(CCCC)cc3O1)OC(C)(C)C=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -15.519
InChIKey:UYTSTXUHPGVKGV-UHFFFAOYSA-N
ID: 113003
SMILES:C12C(C)(C)C1Cc1c(O)cc(CCCCC)cc1OC2(C)CCC=C(C)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.696
CB1 binding score: -12.958
InChIKey:YRNHBGHCZNJVPK-UHFFFAOYSA-N
ID: 113004
SMILES:Oc1cc(CCCCC)cc2c1C1CC(C(=C)CO)CCC2(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -14.843
InChIKey:GUADSWMRNHFVJT-UHFFFAOYSA-N
ID: 113005
SMILES:c1(OCC)c(C2C(C(O)(C)C)CCC(C)=C2)c(O)cc(CCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -15.883
InChIKey:FGSLREURCXRZJN-UHFFFAOYSA-N
ID: 113006
SMILES:Oc1cc(CCCCC)cc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 113007
SMILES:c1(C(=O)NC)c(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 301.386
CB1 binding score: -14.651
InChIKey:VAJBWSIAXQHRPC-UHFFFAOYSA-N
ID: 113008
SMILES:C1(C)=CC(c2c(O)cc(CCCCC)cc2O)C(C(=C)C)CC1C(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -16.947
InChIKey:OXGPKLAUODDAEW-UHFFFAOYSA-N
ID: 113009
SMILES:c1c(CC(C)CC)c2c(c(OC)c1)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -15.251
InChIKey:LYIQQINTQGGUOV-UHFFFAOYSA-N
ID: 113010
SMILES:O=C(c1ccccc1)Oc1c(C2C(C(=C)C)CCC(C)=C2)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.577
CB1 binding score: -16.416
InChIKey:QTMPKYKTBVSCSS-UHFFFAOYSA-N
ID: 113011
SMILES:c1(C(C(O)=NC(=O)C)O)cc(O)c2c(c1)OC(C)(C)C1C2C(O)C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 377.437
CB1 binding score: -18.334
InChIKey:MYDSFANZCZIVSI-UHFFFAOYSA-N
ID: 113012
SMILES:C(=O)(Cc1cc(O)c2c(c1)OC(C)(C)C1=C2C(O)C2(C)C3c4c(O)ccc(O)c4CC3(C)CCC2=C1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 502.607
CB1 binding score: -14.807
InChIKey:SULKCZFXCJYUEY-UHFFFAOYSA-N
ID: 113013
SMILES:CC1(C)C2C(C=C(C)C(=O)C2)c2ccccc2O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.318
CB1 binding score: -16.822
InChIKey:DMWVASKIZHYTIO-UHFFFAOYSA-N
ID: 113014
SMILES:C(CC(O)C)c1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -17.344
InChIKey:WFUFCNZWFCBRLB-UHFFFAOYSA-N
ID: 113015
SMILES:Oc1c(CC2OC2(CCC=C(C)C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -16.502
InChIKey:QODRCBVKQAQONM-UHFFFAOYSA-N
ID: 113016
SMILES:C(c1c(O)cc(CCCCC)cc1OC(=O)C=C(C)C)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.988
InChIKey:YIFBDAHXWPNWSD-UHFFFAOYSA-N
ID: 113017
SMILES:CC(CCC=C(C)C)=CCc1c(O)c(CC=C(C)C)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.748
InChIKey:VRXKPPYOGGSRFK-UHFFFAOYSA-N
ID: 113018
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(C(C)=CC2)CC(C)(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.497
CB1 binding score: -15.191
InChIKey:QOPNRWWJQIYZJT-UHFFFAOYSA-N
ID: 113019
SMILES:C1(C)(C)Oc2cc(OC)cc(O)c2C2C=C(C)CCC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -19.386
InChIKey:BCARDKDANZSKCJ-UHFFFAOYSA-N
ID: 113020
SMILES:c1(OC)cc(CCCCC)cc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.348
InChIKey:FJRQDVCLUUZSIG-UHFFFAOYSA-N
ID: 113021
SMILES:C1CC(C(C)=C)C2c3c(cc(CCCCC)cc3O)OC(C)(C1)CCC=C2C=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -14.638
InChIKey:DIUFAVJTQCGKCN-UHFFFAOYSA-N
ID: 113022
SMILES:CC1Oc2c(c(O)cc(CCCCC)c2)C2C(C(C)=C)CCC12C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -15.886
InChIKey:UWWGTXDFDHFHLD-UHFFFAOYSA-N