ID: 41686
SMILES:C(O)C1(C)Oc2cc(CNC)cc(O)c2C2CC(CO)CCC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 321.417
CB1 binding score: -15.512
InChIKey:OMZHNYMNSCPMCO-UHFFFAOYSA-N
ID: 41687
SMILES:C(CC)Cc1cc(O)c2c(c1C=O)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.265
InChIKey:AMTDOJOFKQNXOY-UHFFFAOYSA-N
ID: 41688
SMILES:O1c2c(cc(CCCCC)cc2O)C(CCC(O)(C)C)C1CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.565
CB1 binding score: -14.83
InChIKey:NWKPBLRAVMFZLE-UHFFFAOYSA-N
ID: 41689
SMILES:c1(O)cc2c(c(C(=O)CC(C)C)c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.937
InChIKey:KGAWLHTXRHUERR-UHFFFAOYSA-N
ID: 41690
SMILES:CCCCCc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C(=O)OC)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.943
InChIKey:CCMWHLPOQSRJEP-UHFFFAOYSA-N
ID: 41691
SMILES:C1(C)(C)CC(=C(C)C)CC(=O)C12Cc1c(O)cc(CCCCC)cc1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -15.479
InChIKey:YTKVLIMXNFBSDB-UHFFFAOYSA-N
ID: 41692
SMILES:C(CCCc1cc2c(c(O)c1)C1CC(C)=CCC1C(C)(C)O2)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -20.649
InChIKey:ZHYPKENABBMAAN-UHFFFAOYSA-N
ID: 41693
SMILES:C12=C(C)C(=O)CC1c1c(cc(CCCCC)cc1O)OC(C)(C)C2CCC(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -17.19
InChIKey:BPDCQRWPMBSGSQ-UHFFFAOYSA-N
ID: 41694
SMILES:C(CCCC)C(c1cc(O)c(C2C=C(C)CCC2C(=CCC=C(C)C)C)c(O)c1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.598
CB1 binding score: -14.37
InChIKey:YXQNGVVZTMXQGG-UHFFFAOYSA-N
ID: 41695
SMILES:CC(CCC=C(C)CO)C1C2=C(C3C=C(C)C(O)CC3C(C)(C)O2)C(=O)C(CCCCC)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.667
CB1 binding score: -12.727
InChIKey:UBIHEPWOKYPDBU-UHFFFAOYSA-N
ID: 41696
SMILES:C(C)CCCCc1cc2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 41697
SMILES:C(Cc1cc(O)cc(CC=C(C)C)c1O)=C(C)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.748
InChIKey:VRXKPPYOGGSRFK-UHFFFAOYSA-N
ID: 41698
SMILES:C1=C(C)CCC2C(C)(C)Oc3ccc(OC)cc3C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.071
InChIKey:QJRPBWFSXAYWJJ-UHFFFAOYSA-N
ID: 41699
SMILES:C1(=O)C2=CC(CCC(=O)C)C3(C)CC2c2c(cc(CCCCC)cc2O)OC(C)(C)C3C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.608
CB1 binding score: -18.937
InChIKey:IHPRPFSNRMWRLV-UHFFFAOYSA-N
ID: 41700
SMILES:C(C(c1c(C=O)ccc2c1OC(C)(C)CC2)(C)C)CC=C(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -13.429
InChIKey:YEDBNVMLHILNBZ-UHFFFAOYSA-N
ID: 41701
SMILES:c1(CCCC)cc2c(c(O)c1)C1C(CC=C(C)C1)C(C)(O)C(O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -12.59
InChIKey:UVXNXFYSMPPNCH-UHFFFAOYSA-N
ID: 41702
SMILES:c12c(O)cc(CCCCC)cc1OC(CCC=C(C)C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -18.559
InChIKey:NEOMHYIKJUAVNS-UHFFFAOYSA-N
ID: 41703
SMILES:CC(C)=CCCC1(C)Oc2c(CCCCC)cc(OC(=O)C)cc2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -16.812
InChIKey:BQMKKDRSBSKWNG-UHFFFAOYSA-N
ID: 41704
SMILES:C123c4c(cc(CCC(=O)C=CCCC)cc4OC(C)(C)C1CC2)OC3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -14.789
InChIKey:VFNPOQDFHLEPJR-UHFFFAOYSA-N
ID: 41705
SMILES:C1CC(C)=CCC=C(C)C=Cc2c(OC)cc(CCCCC)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.508
CB1 binding score: -15.066
InChIKey:UPQGNRXVKPARJS-UHFFFAOYSA-N
ID: 41706
SMILES:C(CC)Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N