ID: 8548
SMILES:CCCCCCc1cc(O)c(C(c2c(O)c(CC=C(C)CCC=C(C)C)c(O)cc2)=O)c(O)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.618
CB1 binding score: -14.841
InChIKey:UYDDUFQHCOYSGF-UHFFFAOYSA-N
ID: 8549
SMILES:C1CC(C)(C)Oc2cc(CCCCC)c(OC(=O)C)c(O)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.402
CB1 binding score: -17.757
InChIKey:YDGHUOPSWUIDJT-UHFFFAOYSA-N
ID: 8550
SMILES:C(C)CCCc1cc2c(c(O)c1)C1C3(O1)C(C)(CC(O)CC3(C)C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -18.556
InChIKey:ZIOZKSLKDITPTL-UHFFFAOYSA-N
ID: 8551
SMILES:CC1CC(=O)C2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.334
InChIKey:VMDONILZKKAZDT-UHFFFAOYSA-N
ID: 8552
SMILES:c12c(c(O)cc(C)c1)C1C(C(C)(C)O2)CCC(C)=CCC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -16.9
InChIKey:PPUDCKVJZTXUDO-UHFFFAOYSA-N
ID: 8553
SMILES:C(CCc1cc(C(=O)O)c2c(c1O)OC(C)(C)C1CCC(C)=CC21)CC(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -15.415
InChIKey:YANWBDBPMRKOOA-UHFFFAOYSA-N
ID: 8554
SMILES:c1c(C(CCO)=O)c2c(c(O)c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -14.936
InChIKey:HLDGXFWVTSNZIW-UHFFFAOYSA-N
ID: 8555
SMILES:C(CCCC)c1cc2c(c(O)c1C=O)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.076
InChIKey:XBESCWCNNPVKJC-UHFFFAOYSA-N
ID: 8556
SMILES:C(CCCCCc1cc(OC)c(C2C=C(C)CCC2C(=C)C)c(OC)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -14.066
InChIKey:PDYBINRAHAWJGR-UHFFFAOYSA-N
ID: 8557
SMILES:C12=Cc3c(cc(CCCCC)cc3O)OC1(C)CCC1C2(C)CCC(C(C)C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.599
CB1 binding score: -13.812
InChIKey:WNMGUTLHCSTDJP-UHFFFAOYSA-N
ID: 8558
SMILES:CC1(C)Oc2c(c(O)cc(C)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -20.957
InChIKey:WIDIPARNVYRVNW-UHFFFAOYSA-N
ID: 8559
SMILES:C(CCCC)Cc1c(O)c2c(c(C)c1)OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.539
CB1 binding score: -14.793
InChIKey:SENMUXZXRIZCHM-UHFFFAOYSA-N
ID: 8560
SMILES:c12c(cc(C)c(O)c1)-c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -18.225
InChIKey:XUERFRQVGLONMR-UHFFFAOYSA-N
ID: 8561
SMILES:CC1(C2CC(C(CO)C)CCC2=O)Oc2c(c(O)cc(CCC)c2)C=C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -16.864
InChIKey:GGASTRLJRMQYPO-UHFFFAOYSA-N
ID: 8562
SMILES:C(O)C1=CC2C(c3c(cc(CCCCC)cc3O)O2)OC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.359
CB1 binding score: -13.454
InChIKey:QHQCKFACHUFLMK-UHFFFAOYSA-N
ID: 8563
SMILES:C1CC2C(C)(C)C3(C2=C)c2c(cc(CCCCC)cc2)OC13
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.454
CB1 binding score: -13.879
InChIKey:ABEPMMTYMITOKI-UHFFFAOYSA-N
ID: 8564
SMILES:C(CCCC)CC1c2c(OC)cc(O)cc2OC(CC)(C)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.446
CB1 binding score: -17.416
InChIKey:XDWMJKFHYXIENI-UHFFFAOYSA-N
ID: 8565
SMILES:CCCc1cc(O)c2c(c1)OC(C)(C)C1CCC(CCCC=C)=CC1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -16.522
InChIKey:ODUCKLBTCGCQRW-UHFFFAOYSA-N
ID: 8566
SMILES:CC(=CCc1c(O)c(CC=C(C)C)cc(O)c1)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.748
InChIKey:VRXKPPYOGGSRFK-UHFFFAOYSA-N
ID: 8567
SMILES:C(=O)C(CCC=C(C)C)=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -17.158
InChIKey:XKYZLVWYJXIOOE-UHFFFAOYSA-N
ID: 8568
SMILES:Oc1cc2c(c(OC)c1C)C1C(CCC1(C)C)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -14.802
InChIKey:SJUULEWEXGOGFN-UHFFFAOYSA-N