ID: 31543
SMILES:CC(C1C(c2c3c4c(cc2OC)CC(C)(C)O4)c(OC)cc(O)c3OC1C1(C)CCC(C(C)(O)C)O1)=C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 512.643
CB1 binding score: -15.084
InChIKey:XGCGALBTHOQVKM-UHFFFAOYSA-N
ID: 31544
SMILES:c1ccc(C(OC)=O)c2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -17.268
InChIKey:FRYWBCGDWIVRPN-UHFFFAOYSA-N
ID: 31545
SMILES:c1(OC)c2c(c(CCCCC)cc1O)OC(C)(C)C1CCC(C(O)=O)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -14.569
InChIKey:RKFWGBNQUAFTIY-UHFFFAOYSA-N
ID: 31546
SMILES:C(CCc1cc(O)c(C(O)=O)c2c1C=CC(CCC=C(CCC=C(C)C)C)(C)O2)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -13.58
InChIKey:UBKVQAZIABVPJW-UHFFFAOYSA-N
ID: 31547
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 31548
SMILES:C(CCCc1cc(O)c(CC=C(CCC=C(C)C)C)c(O)c1)(C)C=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -15.248
InChIKey:AEBHCOVSGHRODR-UHFFFAOYSA-N
ID: 31549
SMILES:C1C2(O)C(=C)CCC(O)(C(C)(C)Oc3cc(CCCCC)cc(O)c31)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -15.211
InChIKey:RZQPOAZMWDUKAQ-UHFFFAOYSA-N
ID: 31550
SMILES:Oc1c(C)cc2c3c1OC(C)(C)C1C3C=C(C)C(C1OC)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -15.677
InChIKey:RWSGKHKIIREWBG-UHFFFAOYSA-N
ID: 31551
SMILES:Oc1c2c(cc(CCC)c1)OC(C)(C)C1C2CC(C)(O)C1CC(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -16.841
InChIKey:AYPUHDCWVGUCCA-UHFFFAOYSA-N
ID: 31552
SMILES:c1(C(OC)=O)c(CCCCC)cc2c(c1O)C1C(C(C)(C)O2)CCc2c1cc(O)c(C)c2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.564
CB1 binding score: -17.814
InChIKey:ICEBKWFNSXARJM-UHFFFAOYSA-N
ID: 31553
SMILES:Oc1c(CCCC)c2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -13.53
InChIKey:MJPFHHRYRNHSMI-UHFFFAOYSA-N
ID: 31554
SMILES:C(C(=CCc1c(O)c(C)cc(O)c1)C)CCC(CO)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -17.352
InChIKey:WMBCLVJDXIYKGS-UHFFFAOYSA-N
ID: 31555
SMILES:C1(C)C2C(C)(Oc3c1c(O)cc(CCCCC=CCC)c3)CCC(C(=C)C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -15.017
InChIKey:TZNVFNDEWRMHPV-UHFFFAOYSA-N
ID: 31556
SMILES:CC1(C)Oc2c(C(O)=O)c(CCCCC)cc(O)c2C=C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.359
CB1 binding score: -17.796
InChIKey:JRDXSDYHHLODOB-UHFFFAOYSA-N
ID: 31557
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C(O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -19.729
InChIKey:GIIVGKMZIUKMMN-UHFFFAOYSA-N
ID: 31558
SMILES:C(=CCCC(C1C2=C(C)CCC13C(C)(CC2)Oc1cc(CCCCC)cc(O)c13)C)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.68
CB1 binding score: -16.591
InChIKey:OLONIECJHJJMOB-UHFFFAOYSA-N
ID: 31559
SMILES:C1=C(C)CCC=C(C)CCC2C(C)(C)Oc3cc(CCCCCN=[N+]=[N-])cc(c32)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 407.602
CB1 binding score: -13.381
InChIKey:ATFHNYWFXWNQQZ-UHFFFAOYSA-N
ID: 31560
SMILES:C(CCC=C(C)C)(C)=CCc1c(O)cc(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -19.824
InChIKey:YJYIDZLGVYOPGU-UHFFFAOYSA-N
ID: 31561
SMILES:CC1(C)C2C(c3c(cc(CCCCC)cc3O)O1)C=C(C=O)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -19.053
InChIKey:HQRKNUDGMPVIMO-UHFFFAOYSA-N
ID: 31562
SMILES:O1C(C2C(C)(C)OC(=O)CC2)CCC(C)=C1c1cc(C(C(=O)O)C)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.46
CB1 binding score: -15.445
InChIKey:SKZLNDIQNFSCCB-UHFFFAOYSA-N
ID: 31563
SMILES:C(=CCCC(=CCc1c(O)cc(CCCCC)c(C=O)c1O)C)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 344.495
CB1 binding score: -19.069
InChIKey:ROXSKQXJGMFFHX-UHFFFAOYSA-N