ID: 108529
SMILES:C1CC(C)(C)OOc2c(C(C(CC)O)=O)c(O)cc(CCCCC)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.455
CB1 binding score: -15.588
InChIKey:PFMWQECNECMMHV-UHFFFAOYSA-N
ID: 108530
SMILES:C(=O)c1cc(O)c2c(c1)OC(C)(C)C1C2CC(=C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -15.603
InChIKey:AOBOQNXEXQPOQB-UHFFFAOYSA-N
ID: 108531
SMILES:C1(C)=CC(c2c(O)cc(C=Cc3c(O)cc(CCCCC)cc3O)cc2OC)C(C(C)=C)CC1
Pathway: Polyketides;Shikimates and Phenylpropanoids;Terpenoids
Superclass: Meroterpenoids;Stilbenoids
Class: Cannabinoids;Monomeric stilbenes
MW: 462.63
CB1 binding score: -15.655
InChIKey:CGXJDJIEZPEMDJ-UHFFFAOYSA-N
ID: 108532
SMILES:C(=C(C(O)=O)C)CCC(C)=CCc1c(O)cc(CCCCC)cc1OC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -16.705
InChIKey:YKUNZXHVAIWLLV-UHFFFAOYSA-N
ID: 108533
SMILES:c1(CCCCC)cc2c(c(O)c1)C1CC(C(O)=O)CC(=O)C1(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.369
InChIKey:ZRXPTFWSRJDAFQ-UHFFFAOYSA-N
ID: 108534
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 108535
SMILES:C(CCC)Cc1cc(O)c(C2C(C(=C)C)CCC(C)C2)c(CCC=C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.578
CB1 binding score: -15.869
InChIKey:YISDIXMFLAQJJD-UHFFFAOYSA-N
ID: 108536
SMILES:C(CC)CCc1cc2c(c(O)c1)C1C(C(C)C)CCC1(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -18.251
InChIKey:GIVNWDNDDALTHM-UHFFFAOYSA-N
ID: 108537
SMILES:C(CCCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)C(=O)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.736
InChIKey:CWNRMLSJCWFXPH-UHFFFAOYSA-N
ID: 108538
SMILES:CC(C(C)C=CC(C)(C)O)=CCCC(=CCc1c(O)cc(CCc2ccc(O)cc2)cc1O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.646
CB1 binding score: -16.592
InChIKey:DRTYFOCCJFALAX-UHFFFAOYSA-N
ID: 108539
SMILES:O1c2c(cc(CCCCC)cc2O)CC(CCC=C(C)C)(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -17.131
InChIKey:CMWVBMJOSAYCLS-UHFFFAOYSA-N
ID: 108540
SMILES:c1(C(C)C)c2cc(C)c(O)c1-c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -15.034
InChIKey:UOKGYLFSFCWXEA-UHFFFAOYSA-N
ID: 108541
SMILES:C1CC2(C)OC(CC(=CCc3c(O)c(C)cc(O)c3)C)=CC1C(C)=CC2CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.609
CB1 binding score: -16.682
InChIKey:POBLUXPGTICWEA-UHFFFAOYSA-N
ID: 108542
SMILES:C1(C(C)C)CCC(C)CC1c1c(O)cc(CCCCC)cc1OC(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.538
CB1 binding score: -18.271
InChIKey:UODLHUGHESMPTP-UHFFFAOYSA-N
ID: 108543
SMILES:CCCCCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)(OO)C=C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -17.115
InChIKey:LPRGWTXANSVHJQ-UHFFFAOYSA-N
ID: 108544
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 108545
SMILES:C1C(C)=CC(c2c(O)cc(CCC)cc2O)C(C(=C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N
ID: 108546
SMILES:CCCCCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 108547
SMILES:CC1CC(c2c(O)cc(CCCCC)cc2OC)C(C(C)(C)O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.527
CB1 binding score: -16.675
InChIKey:KAVBBTXBQGTASU-UHFFFAOYSA-N
ID: 108548
SMILES:C12C(CO)(C)Oc3cc(CCCCC)cc(O)c3C1CC(C)=CC(O)CC(=C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -11.814
InChIKey:MRMUTSJBNNHGGS-UHFFFAOYSA-N
ID: 108549
SMILES:C1(C(=C)C)C(c2c(O)cc(CCCCC)c(Cc3c(O)cc(CCC)cc3OC)c2)CC(C)=C1C=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 490.684
CB1 binding score: Not available
InChIKey:YQYQAXCPFMDMLN-UHFFFAOYSA-N