ID: 90574
SMILES:C1(CCCC(C)(O)C)(C)Oc2c(cc(CCCCC)cc2O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.5
CB1 binding score: -16.813
InChIKey:ZAFWITGZZMDSKT-UHFFFAOYSA-N
ID: 90575
SMILES:C12c3c(O)cc(CCCCC)c(c3C3(O)CC(O)C(C)(C)OC31C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -12.827
InChIKey:JUBHXFNRWYFNIW-UHFFFAOYSA-N
ID: 90576
SMILES:C12C(CCC3(C)C(C1)OOC1(C)OC13)C(C)(C)Oc1c2cccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -13.463
InChIKey:VMRFBCMGWMHCQE-UHFFFAOYSA-N
ID: 90577
SMILES:OCC1(C)Oc2cc(O)cc(C)c2C2C1CCC(C)=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -15.116
InChIKey:PEOZFWCOAZTCTP-UHFFFAOYSA-N
ID: 90578
SMILES:c1c2c(c(C)cc1O)C(CC(C)C)=CC(CCC=C(C)C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.929
InChIKey:NNAQQWYEYRECMP-UHFFFAOYSA-N
ID: 90579
SMILES:C1CC2(C)Oc3c(c(O)cc(CCCCC)c3)C(C=C(C)C)C2C(=O)C(O)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -17.131
InChIKey:WPNURXQUFZLYBP-UHFFFAOYSA-N
ID: 90580
SMILES:C(C)(=CCc1c(O)c(CC=C(C)CCC=C(C)C)cc(O)c1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.748
InChIKey:VRXKPPYOGGSRFK-UHFFFAOYSA-N
ID: 90581
SMILES:COc1c(C2C=C(C)CCC2C(=C)C)cc(O)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -16.399
InChIKey:RBNMYFADHIXZJQ-UHFFFAOYSA-N
ID: 90582
SMILES:CCCCCCc1c(C(=O)OC)c(O)c(CC=C(C)CCC=C(COC(C)=O)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.584
CB1 binding score: -14.803
InChIKey:GSGYZWLZVSBKPS-UHFFFAOYSA-N
ID: 90583
SMILES:Oc1cc2c(c(CC=C(CCC=C(C)C)C)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -17.154
InChIKey:PTOQHADZIOJFKL-UHFFFAOYSA-N
ID: 90584
SMILES:C(CCc1cc(O)c2c(c1)OC(CO)(C)C2CCC(C)=O)C=CC=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.423
CB1 binding score: -16.254
InChIKey:MFAALFCFFZOVOZ-UHFFFAOYSA-N
ID: 90585
SMILES:C(CCC(=CCc1c(O)cc(CCc2ccccc2)cc1O)C)=C(C)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.621
CB1 binding score: -19.13
InChIKey:IWSASXREQYAISF-UHFFFAOYSA-N
ID: 90586
SMILES:OC1C2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C2C2CC(C)(O)C3C(C12C)C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -14.846
InChIKey:CULJCAFTHPHHAJ-UHFFFAOYSA-N
ID: 90587
SMILES:CC1=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.534
InChIKey:INKUWBOHCFHXTJ-UHFFFAOYSA-N
ID: 90588
SMILES:C12C(c3c(O)cc(CCCCC)cc3OC(C)(C)C1CC=C(C)C)CC(C)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -14.728
InChIKey:VYAXLZNYUNVLGU-UHFFFAOYSA-N
ID: 90589
SMILES:C(Cc1c(C=O)c2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -17.611
InChIKey:QXUCLIISXIFDCN-UHFFFAOYSA-N
ID: 90590
SMILES:C1CC(C)C2(C)Oc3c(c(O)cc(CCCCC)c3)C3C2C(C)(C)C1O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -16.429
InChIKey:UOBWOFRLSWGESJ-UHFFFAOYSA-N
ID: 90591
SMILES:C1(C(O)=O)=CCC2c3c(cc(CCCCC)cc3O2)OC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.343
CB1 binding score: -16.566
InChIKey:KIOLUIMPIQFRGC-UHFFFAOYSA-N
ID: 90592
SMILES:c1c2c(cc(O)c1CC(=O)OC)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -16.793
InChIKey:PXYRWYHWNXCHOG-UHFFFAOYSA-N
ID: 90593
SMILES:CCCCCCc1cc2c(c(O)c1)C1CC(C)=CCC1C(CO)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -17.388
InChIKey:QXYJUIVJQNYJQF-UHFFFAOYSA-N
ID: 90594
SMILES:C1C2C3(CC(CC2)c2c(O)cc(CCCCC)cc2O3)C(OC)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -15.234
InChIKey:WEJNDGUPADLIRF-UHFFFAOYSA-N