ID: 42421
SMILES:O(CCN(C)C)c1cc(CCCCC)cc2c1OC1(C)C(C2)C2(C)CCC(C(C)C)=C2CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 453.711
CB1 binding score: -15.552
InChIKey:UHYUKKKOMOLNQD-UHFFFAOYSA-N
ID: 42422
SMILES:C1c2c(cc(CCCCC)cc2O)OC2(C1(C)C)C(O)CC(C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.912
InChIKey:JPGQSFBIFRBIKU-UHFFFAOYSA-N
ID: 42423
SMILES:O=C(C)Oc1cc(C)c(OC(C)=O)c(CC=C(C)CCC=C(C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.334
InChIKey:RAISXEOPUCKKJW-UHFFFAOYSA-N
ID: 42424
SMILES:COc1c(O)ccc2c1C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -16.675
InChIKey:RCGGCIQYEGNVJJ-UHFFFAOYSA-N
ID: 42425
SMILES:C1=C(C)C(=O)CC2C(C)(C)Oc3cc(C(C)C)ccc3C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -16.829
InChIKey:QWNBSAOQIMFGBD-UHFFFAOYSA-N
ID: 42426
SMILES:C1(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 42427
SMILES:c12cc(CCCCC)cc(O)c1OC1(CCC3C(OC(=O)C)(C)CCC(C(C)(C)O)OC3C1)Cc1c(O)cc(C)cc1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 596.761
CB1 binding score: -13.258
InChIKey:OGBFXRZNCMYTNF-UHFFFAOYSA-N
ID: 42428
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C(CCC(CO)=C1)C(C)(CC(=O)CC(OC)=O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.541
CB1 binding score: -14.579
InChIKey:RGYIAHZKBUUKPW-UHFFFAOYSA-N
ID: 42429
SMILES:C12(C)OC(C)(C)C(CC1)C(O)c1c(O)c(C(=O)O)c(CCCCC)cc1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.465
CB1 binding score: -15.047
InChIKey:VAERTWWFOZJFNM-UHFFFAOYSA-N
ID: 42430
SMILES:C1=C(C)CCC(C(C)=C)C1c1c(O)cc(C)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.979
InChIKey:GKVOVXWEBSQJPA-UHFFFAOYSA-N
ID: 42431
SMILES:C(Cc1cc2c(c(O)c1)C1C(C(=C)C)CCC(C)(O)C1O2)OC(C)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.423
CB1 binding score: -14.402
InChIKey:OWOOIQRCQGPTDG-UHFFFAOYSA-N
ID: 42432
SMILES:c1(CCCCC)cc2c(c(O)c1)C1CC(C)(CCC1C(=C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.198
InChIKey:NUXUDGMVYZUFNQ-UHFFFAOYSA-N
ID: 42433
SMILES:c12c(cc(CCCC)cc1O)OC(C)(C)C1OC(C=C(C)C)CC3(C=C1C)C(O)OC3=CCC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.634
CB1 binding score: -14.043
InChIKey:MPHNVRUWGWUWPS-UHFFFAOYSA-N
ID: 42434
SMILES:C(CCC)CCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)(O)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -16.422
InChIKey:ONEUKPJXXAERDP-UHFFFAOYSA-N
ID: 42435
SMILES:C1=C(C)CCC2C(C)(C)Oc3cc(C)c(Br)cc3C12C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 335.285
CB1 binding score: -16.196
InChIKey:PRZPCFRXHXJJBK-UHFFFAOYSA-N
ID: 42436
SMILES:C(c1c2c(ccc1O)OC1(C)C3C(C(C)(C)O3)CC21)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -16.38
InChIKey:SOYMQGACJQHSEP-UHFFFAOYSA-N
ID: 42437
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)CC1)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.539
CB1 binding score: -17.402
InChIKey:USZILQYXSONCHH-UHFFFAOYSA-N
ID: 42438
SMILES:C(c1cc(OC)c2c(c1)OC(C)(CCC=C(C)C)C=C2)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -17.164
InChIKey:MCWBKWQLHUEDHY-UHFFFAOYSA-N
ID: 42439
SMILES:C(=CCCC(C)=CCc1c(O)c(OC)cc(CCCC)c1)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -16.515
InChIKey:PTWVNRCVRZPOIU-UHFFFAOYSA-N
ID: 42440
SMILES:c1(C)c2c(c(=O)cc(CCCCC)c1)OC(C)(C)C(O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -16.114
InChIKey:GJZPOMIXIPYZEV-UHFFFAOYSA-N
ID: 42441
SMILES:Oc1cc(CCCCC)cc2c1C1C=C(C(O)=O)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N