ID: 31753
SMILES:C(=C(C)C)CCC(C)(C1CCC(C)=CC1c1c(O)cc(CCCCC#CCCCC)cc1O)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.706
CB1 binding score: -13.686
InChIKey:HCGIDYKLMYRHGH-UHFFFAOYSA-N
ID: 31754
SMILES:Oc1c(C)cc(OC)cc1CC=C(CC(C=C(CCCCc1cc(C=O)ccc1)C)O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.592
CB1 binding score: -17.033
InChIKey:UPBALJDYUFPWFI-UHFFFAOYSA-N
ID: 31755
SMILES:C1C(C(=C)C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 31756
SMILES:C(C)CCCc1cc2c(c(O)c1)C1CC(CO)(C(O)CCC1(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -14.527
InChIKey:HJQNHIBMLOIOOX-UHFFFAOYSA-N
ID: 31757
SMILES:CC(=CCCC(=CCCC(C)=CCc1c(O)cc(CC(C)OC(c2ccccc2)=O)cc1O)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 476.657
CB1 binding score: -13.125
InChIKey:MJKLUADJGGPRFY-UHFFFAOYSA-N
ID: 31758
SMILES:C(C(C(=O)C(O)C)C(CC(C)C)c1c(O)c(C2C=C(C)C(O)CC2C(C)=C)c(O)cc1O)=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 554.768
CB1 binding score: -15.748
InChIKey:WUETYRQSCCKVNL-UHFFFAOYSA-N
ID: 31759
SMILES:c1c2c(C)c(O)cc1-c1c(cc(CCCCC)cc1O)OC(C)(C)C2CC=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 476.701
CB1 binding score: -18.31
InChIKey:SNKSPCHZXMUGEG-UHFFFAOYSA-N
ID: 31760
SMILES:C12C(C(O)C(C)=CC1)c1c(c(OC)c(OC)cc1C)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -16.03
InChIKey:WTSHGNIBYAPPFK-UHFFFAOYSA-N
ID: 31761
SMILES:C1C(C)C2(Oc3c(c(O)cc(CCCCC)c3)C2)C2(OC(=O)C(C)=C2)OC1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.444
CB1 binding score: -15.403
InChIKey:ZYTKZLRMVHOXFY-UHFFFAOYSA-N
ID: 31762
SMILES:CC1(C)OC2C3(OC(=O)c4c(CCCCC)cc(O)c(CC=C(CCC=C(C)C)C)c4)C2CC1C3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.689
CB1 binding score: -15.402
InChIKey:KGDRZSWPRBFDLX-UHFFFAOYSA-N
ID: 31763
SMILES:c1c(CCCCC)cc2c3c1OC1(C)CCC(C3C1)C2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -14.319
InChIKey:OVRFQTSVOHOSKO-UHFFFAOYSA-N
ID: 31764
SMILES:C(Cc1cc(O)c(C2C(C(C)=C)CC=C(C)C2)c(O)c1)CC=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.626
CB1 binding score: -15.021
InChIKey:NNQFNYVCUMGEOC-UHFFFAOYSA-N
ID: 31765
SMILES:C(OC)(=O)CCc1cc2c(c(O)c1)C1C(C(O)(C)CCC=C(C)C)OC(CCC1=C)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 472.622
CB1 binding score: -14.86
InChIKey:ZMFHPZQZDYRPSQ-UHFFFAOYSA-N
ID: 31766
SMILES:C1(O)CC(C)(C)Oc2c(cc(CCCCC)cc2O)C1OC(=O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 336.428
CB1 binding score: -15.392
InChIKey:IIJIOJPCKUZCTI-UHFFFAOYSA-N
ID: 31767
SMILES:c1(CCC)cc(O)c2c(c1)OC(C)(C)C1C2C=C(C(OC)=O)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.423
CB1 binding score: -15.579
InChIKey:YZLFHGNMFCSYEZ-UHFFFAOYSA-N
ID: 31768
SMILES:CC(=CCCC(C)=CCc1c(O)cc(CCc2ccc(OS(=O)(O)=O)cc2)cc1O)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 514.684
CB1 binding score: -14.499
InChIKey:PUSZJIKOTWWMCM-UHFFFAOYSA-N
ID: 31769
SMILES:O1C2(c3c(cc(CCCCC)cc3O)OC1(C)C)C1C(C(O)(C)C2)C(=O)C=C1CO
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.514
CB1 binding score: -14.578
InChIKey:UXOAZYTZTLXLAM-UHFFFAOYSA-N
ID: 31770
SMILES:C(O)(C1CCC(C)=CC1c1ccc(CCCCC)cc1)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -18.046
InChIKey:MXECOWWPQRFPTG-UHFFFAOYSA-N
ID: 31771
SMILES:c1c(O)c2c(cc1C(Cl)C)-c1c(OC)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.935
CB1 binding score: -13.755
InChIKey:ZQVWXLUWBCVDET-UHFFFAOYSA-N
ID: 31772
SMILES:C12C(C)=CC=C1C(CO)(C)Oc1cc(O)cc(CCCCC)c12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -15.395
InChIKey:LYDHAWLJLJCTFV-UHFFFAOYSA-N
ID: 31773
SMILES:C12C(C(C)C)(O)CC(C)C(=O)C1c1c(cc(CCC)cc1O)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -15.353
InChIKey:XINULFXOSZPUIX-UHFFFAOYSA-N