ID: 71842
SMILES:C(CCCC)c1cc(O)c(C2C=C(C)CCC2C(=C)C)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.048
InChIKey:FUZJMTMPVZRGQF-UHFFFAOYSA-N
ID: 71843
SMILES:CC1=CCCC(C(O)=O)CCC2C(CO)(C)Oc3c(c(O)cc(CCCCC)c32)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -16.1
InChIKey:HBVVAJGXLNRRGD-UHFFFAOYSA-N
ID: 71844
SMILES:C(O)(C1Cc2c(c(C=O)c(CCCCC)cc2O)O1)CC=C(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -15.131
InChIKey:WQLXGTWXFQGSSB-UHFFFAOYSA-N
ID: 71845
SMILES:C(CO)=Cc1cc(OC)c2c(c1)OC(C)(C)C1(O)CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -14.726
InChIKey:LOWCMKUQZYZTSR-UHFFFAOYSA-N
ID: 71846
SMILES:O=C1Oc2c(OC)cc(CCCCC)cc2C2CC3CC(C(O)C21)OC3(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -14.553
InChIKey:KCKTWKGMTFAILA-UHFFFAOYSA-N
ID: 71847
SMILES:C1CC(C(C)=C)Cc2c(C(O)=O)c(CCCCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -16.469
InChIKey:CEKRPBIJEDITKF-UHFFFAOYSA-N
ID: 71848
SMILES:C(CCC(c1c(O)cc(CCCCC)cc1O)C)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Bisabolane sesquiterpenoids;Cannabinoids
MW: 290.447
CB1 binding score: -17.404
InChIKey:LIFOCERVKVJSNG-UHFFFAOYSA-N
ID: 71849
SMILES:C(CCCC)Cc1cc2c(cc1O)C(C(=O)C1CC=C(C)C(O)CC(O)C(=C)CC1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.569
CB1 binding score: -16.425
InChIKey:CKAWOEXETTUXFP-UHFFFAOYSA-N
ID: 71850
SMILES:C(CCCCCc1cc2c(c(O)c1C=O)OC1C=C(C)CCC1C(C)(C)O2)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.64
CB1 binding score: -14.299
InChIKey:KVIBJOUXBMJVNI-UHFFFAOYSA-N
ID: 71851
SMILES:CC12Oc3ccc(CCCCC)cc3CC1(O)C(C)C(C)OC2=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -16.848
InChIKey:DBTKDBGIUSOAQB-UHFFFAOYSA-N
ID: 71852
SMILES:c1(O)cc(CCCCC)cc2c1C1=C(C(C)(C)O2)C(=O)C2(CC1CC(C)=O)OC(C)(C)C1=C2C=CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 504.667
CB1 binding score: -10.968
InChIKey:YHDQRCZJKJWUCZ-UHFFFAOYSA-N
ID: 71853
SMILES:CC(c1c2c(c3c(c1OCC(CCCCCC)C)c1c(cc3)OC(C)(C)C3CCC(C)=CC13)O2)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 476.701
CB1 binding score: -15.763
InChIKey:SBWIVRYGWPRBTB-UHFFFAOYSA-N
ID: 71854
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 71855
SMILES:c1(O)c(CC=C(C)CCC=C(C)C)cc(O)cc1CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.009
InChIKey:XKWLUCZAWFMDAL-UHFFFAOYSA-N
ID: 71856
SMILES:C(OC(CC)=O)(C)=CCc1c(OC)cc(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: -13.598
InChIKey:WYKXQRZYBNWRJX-UHFFFAOYSA-N
ID: 71857
SMILES:C(CCCc1cc2c(c(O)c1)C1C(=C(C)CC(O)C3C(C)(C)O3)CCC(C)(O2)C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -16.581
InChIKey:ZDVITCNHUYSAGB-UHFFFAOYSA-N
ID: 71858
SMILES:C1(C)(C)C2CCC(C)=CC2Cc2c(cc(CCC(CC)O)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -13.905
InChIKey:GAOBHTHJCCPEFD-UHFFFAOYSA-N
ID: 71859
SMILES:c1(C)c(CCCCC)cc2c(c1O)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.218
InChIKey:CNCURDLLOPZUIO-UHFFFAOYSA-N
ID: 71860
SMILES:c12c(OC)c(C(=O)OC)c(CCCCC)cc1OC(C)(C)c1c-2cc(C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.5
CB1 binding score: -16.335
InChIKey:VXBNMVMCAOESMV-UHFFFAOYSA-N
ID: 71861
SMILES:C1=C(C)CCC2(C)C(O)CC(C)C2c2c(OC(C)=O)cc(CCCCC)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -14.553
InChIKey:IJRIOTUNKKQTRG-UHFFFAOYSA-N
ID: 71862
SMILES:C(O)(C1=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N