ID: 56701
SMILES:C1=C(C)C2=Cc3c(O)cc(CCCCC)cc3OC2(C)C=C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.41
CB1 binding score: -15.622
InChIKey:ZOUXEZWJXHYXLU-UHFFFAOYSA-N
ID: 56702
SMILES:CC(=CCCC1(C)Oc2c(c(=O)cc(CCC)cc2O)C=C1)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -16.503
InChIKey:MFTNTPGQLQMJIO-UHFFFAOYSA-N
ID: 56703
SMILES:C1(C)(C=CC=C(C)C)C=Cc2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -17.758
InChIKey:IMOQHDXEXYQZLQ-UHFFFAOYSA-N
ID: 56704
SMILES:c1(O)c2c(cc(CCCCC)c1)C1C(CCC(COC)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.857
InChIKey:PUXLCXWKNXFXAQ-UHFFFAOYSA-N
ID: 56705
SMILES:Oc1cc(CCCCC)cc2c1C13OC(=O)C(C)=C1CC1C(=C)CCC(OC(C)=O)C1(C)C3O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.574
CB1 binding score: -17.078
InChIKey:LZMPVCKIJLRQFA-UHFFFAOYSA-N
ID: 56706
SMILES:C1C(C)(C)CCC(C)=C2C1c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.072
InChIKey:SXHGVIMPYPNISM-UHFFFAOYSA-N
ID: 56707
SMILES:C(C)(CCCc1cc2c(c(O)c1)C1C(C(C)(OC)CCC1C(C)=C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -17.016
InChIKey:RNAQKHYSKCJNMD-UHFFFAOYSA-N
ID: 56708
SMILES:c1(C(OC)CC(C(C)=C)=O)c(CCCCC)cc2c(c1O)C=CC(CCC=C(C)C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.624
CB1 binding score: -13.433
InChIKey:SPGZWWREJKSRFQ-UHFFFAOYSA-N
ID: 56709
SMILES:C(C)CCCCc1cc2c(c(O)c1)C1CC(C)(CCC1C(=C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.354
InChIKey:LOTJAJIHOKJTOT-UHFFFAOYSA-N
ID: 56710
SMILES:Oc1c(C(CC(C)C)=O)c(O)c2c(c1)OC(C)(C)C1C2C(O)C(O)(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.465
CB1 binding score: -15.706
InChIKey:NRKWBYGUXKBQEG-UHFFFAOYSA-N
ID: 56711
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1C2CC(O)(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -20.807
InChIKey:KSGRDIFQZVURIF-UHFFFAOYSA-N
ID: 56712
SMILES:C(CCC)Cc1cc2c(c(O)c1C=O)OC(C)(C)C1C2CC(=C)C2C1C=C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.582
CB1 binding score: -15.29
InChIKey:XSOXVPNMDZPHGE-UHFFFAOYSA-N
ID: 56713
SMILES:O1C2(CC(OC)c3cc(O)c(CC=C(CCC=C(C)C)C)c(O)c3)C3C(C(C)(O)CCC13)OC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 472.622
CB1 binding score: -14.188
InChIKey:HOTWJTZGMFPYSF-UHFFFAOYSA-N
ID: 56714
SMILES:C(CCCC)Cc1cc(O)c2c(c1)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.458
InChIKey:LZFSGTNLAZDDKK-UHFFFAOYSA-N
ID: 56715
SMILES:ClCCc1c(C)c2c(c3c1CC(C)(C)O3)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.952
CB1 binding score: -14.351
InChIKey:ZMGDJLHNZSVFMW-UHFFFAOYSA-N
ID: 56716
SMILES:O(c1cc(C)c2c(c1CCOC(C=C(CCO)C)=O)OC(C)(C)C2)CCCC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -15.116
InChIKey:HDVHWOTZDRSANJ-UHFFFAOYSA-N
ID: 56717
SMILES:O(C1C(C)(C)CCCC2(C)Oc3c(c(O)c(C(=O)O)c(CCCCC)c3)C21)C(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.53
CB1 binding score: -16.729
InChIKey:ORLLKBHAMOYOLA-UHFFFAOYSA-N
ID: 56718
SMILES:C=C(C)C1CCC(CO)=CC1c1ccc(CCCCO)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -15.466
InChIKey:ZPZCVQLFWAQMHB-UHFFFAOYSA-N
ID: 56719
SMILES:C(CCCC)c1cc(O)c(C2C=C(C(OC)=O)CCC2C(C)=C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.548
InChIKey:RHJKRZKJTFBETO-UHFFFAOYSA-N
ID: 56720
SMILES:O=CC(c1c(C(=O)O)c2c(cc1C)OC(C)(C)C1=C2C(C)CC1)c1c(CCCCC)cc2c(c1O)OC(CCC=C(C)C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 694.953
CB1 binding score: -15.707
InChIKey:PMUJDAIOTVIDTJ-UHFFFAOYSA-N
ID: 56721
SMILES:C1(C(=C)C)CCC(C)=CC1c1c(O)cc(CCCCCO)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.184
InChIKey:ZKGKOAJUWMGRFB-UHFFFAOYSA-N