ID: 81691
SMILES:C(CCC)Cc1cc2c(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: 81692
SMILES:C(Cc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2)=C(C)CCC=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 448.691
CB1 binding score: -15.981
InChIKey:UOITXFMLEYRAPZ-UHFFFAOYSA-N
ID: 81693
SMILES:CC(COc1cc(CCCCC)cc2c1C1C(CCC(C)=C1)C(C)(C)O2)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -16.407
InChIKey:XUNXMJWBOIJPKT-UHFFFAOYSA-N
ID: 81694
SMILES:O1c2c(cc(CCCCC)cc2O)C(O)C2(C)CCC(C(C)=C)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: Not available
InChIKey:DGLSZOGNVZENQW-UHFFFAOYSA-N
ID: 81695
SMILES:C(CC)(O)CCc1cc2c(c(OC)c1)C=CC(CCCC(C)=CC1OC(=O)C(C)=C1)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.553
CB1 binding score: -12.143
InChIKey:PEEBDRZRCYPQGM-UHFFFAOYSA-N
ID: 81696
SMILES:OC(c1ccc(C2(C)OC(C)(C)CCC2)c(O)c1)CCCCC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.473
CB1 binding score: -13.656
InChIKey:VTMOTRITYQFLIA-UHFFFAOYSA-N
ID: 81697
SMILES:C(C)CCCc1cc2c(c(O)c1)C1C(CC3C(C)C(C1O)O3)C2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -14.699
InChIKey:KCTUVIABSJFHDV-UHFFFAOYSA-N
ID: 81698
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1(O)C(C=C(C)C)C2(O)C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.575
CB1 binding score: -16.611
InChIKey:QNOQOKIHOQIHLC-UHFFFAOYSA-N
ID: 81699
SMILES:CC1(C)Oc2c(c(O)cc(CCc3ccccc3)c2)C2CC(OO)(C)CCC12
Pathway: Shikimates and Phenylpropanoids;Terpenoids
Superclass: Meroterpenoids;Stilbenoids
Class: Cannabinoids;Monomeric stilbenes
MW: 382.5
CB1 binding score: -11.183
InChIKey:MTPCCSPXNNXZKH-UHFFFAOYSA-N
ID: 81700
SMILES:C=C1CCC(C(C)C)C(c2c(O)cc(CCCCC)cc2)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -15.758
InChIKey:VEHNCMHPEBSIQC-UHFFFAOYSA-N
ID: 81701
SMILES:c1(OC)cc(CO)cc(O)c1C1C(CC=CC(C(C)C)C)(C)C2CC1=C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -16.29
InChIKey:ISFKULQTRRBVAW-UHFFFAOYSA-N
ID: 81702
SMILES:C(CCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CC(O)C(C)=C1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -14.384
InChIKey:AUJNAFRCECRMBE-UHFFFAOYSA-N
ID: 81703
SMILES:C(C1=CC2Oc3c(c(O)cc(CCCCC)c3)C2C(C)(O)C(O)CC2C1OC(=O)C2=C)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 482.617
CB1 binding score: -13.637
InChIKey:MNPDRPQCCTVANL-UHFFFAOYSA-N
ID: 81704
SMILES:C1(C)=CC(c2c(O)cc(CCCCC)cc2)C(C(CCl)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.915
CB1 binding score: -16.198
InChIKey:NEVRCYVCMFHPIA-UHFFFAOYSA-N
ID: 81705
SMILES:C12c3c(O)cc(C)cc3OC(C)(C)C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -20.957
InChIKey:WIDIPARNVYRVNW-UHFFFAOYSA-N
ID: 81706
SMILES:C1(C(=C)CO)CCC(C(OC)=O)=CC1c1c(O)cc(CCCCCO)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.476
CB1 binding score: -14.604
InChIKey:MAJXDPXDMZGLBT-UHFFFAOYSA-N
ID: 81707
SMILES:C(OC(C)=O)(C)(C)C1Cc2c(O)cc(CCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.348
CB1 binding score: -13.07
InChIKey:ROSSPAXJRQLHDD-UHFFFAOYSA-N
ID: 81708
SMILES:C1(c2c(O)cc(C(=O)O)cc2)CC(C(O)C=C(CCC=C(C)C(O)CC=C(C)C)C)(C)Oc2ccc(CCCC)c(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 592.773
CB1 binding score: -15.717
InChIKey:UUKHSYBWTGXEBY-UHFFFAOYSA-N
ID: 81709
SMILES:C(CCc1cc(C2C(C(=C)C)CCC(C)=C2)c(O)c(C=O)c1O)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.408
CB1 binding score: -13.784
InChIKey:AFENQXNQEPTBIT-UHFFFAOYSA-N
ID: 81710
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1C2CC(C)(O)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -17.774
InChIKey:GKYGKYSJIDSYCQ-UHFFFAOYSA-N
ID: 81711
SMILES:C(C)(=CCCC(C)=CCCC1(C)Oc2c(c(O)cc(CCCCC)c2O)C=C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -19.3
InChIKey:NEIDDCOXTPSTFZ-UHFFFAOYSA-N