ID: 32761
SMILES:C(CCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -18.354
InChIKey:OJTMRZHYTZMJKX-UHFFFAOYSA-N
ID: 32762
SMILES:CC1(CO)CCCC2=Cc3c(cc(CCCCC)cc3O)C(Cl)C(C)=C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.952
CB1 binding score: -16.94
InChIKey:LSHBPVZXAFKZST-UHFFFAOYSA-N
ID: 32763
SMILES:COc1c(O)c2c(c(C)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -17.726
InChIKey:KOLIBXANVISKAU-UHFFFAOYSA-N
ID: 32764
SMILES:C1C2C3=C(C(C)(C(=O)OC)CCC3)CCC2(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -14.476
InChIKey:MTHFSUUYPLARSV-UHFFFAOYSA-N
ID: 32765
SMILES:c12c(ccc3c1C(=O)CCC3(C)C)-c1c(O)cc(CCCCC)cc1OC2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.485
CB1 binding score: -14.595
InChIKey:DBSBMLHQEMCUAL-UHFFFAOYSA-N
ID: 32766
SMILES:CC1(O)CCC2CC3(C)C(CC2(C)C1C)Oc1c3c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -13.905
InChIKey:INTXTOKRWRZEIB-UHFFFAOYSA-N
ID: 32767
SMILES:CC(C)=CCCC(C)=CCc1c(O)cc(CCCCC)c(C(=O)O)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 32768
SMILES:C1CCC2(CO)C(c3c(O)cc(CCCCC)cc3OC2(C)C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -14.552
InChIKey:WXXFABUKHQFUJT-UHFFFAOYSA-N
ID: 32769
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(C(O)=O)=CCC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -16.319
InChIKey:FDBXLSVXSCZMKH-UHFFFAOYSA-N
ID: 32770
SMILES:C(c1c(O)c2c(cc1OC)OC(C)(C)C1CC=C(C)CC12)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -14.442
InChIKey:QGCHPGRYNARCBV-UHFFFAOYSA-N
ID: 32771
SMILES:C(c1cc2c3c(c1O)OC1(C)CC3C(C(C)(C)O2)CC1)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.408
InChIKey:WNQIDWPQIMRGBK-UHFFFAOYSA-N
ID: 32772
SMILES:C1(=O)C(CCCC(C)O)(C)Oc2cc(CCCCC)cc(O)c2C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -15.358
InChIKey:RKQKLEMDBYVNKK-UHFFFAOYSA-N
ID: 32773
SMILES:C12C(C)CC=C1C(CC(C=C(C)C)=O)(C)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -11.265
InChIKey:DAJQXCQJSZGYOK-UHFFFAOYSA-N
ID: 32774
SMILES:COc1c(CCCC)cc(O)c2c1OC(C)(C)C=C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.349
CB1 binding score: -16.967
InChIKey:JDBZDRAXFUUTLH-UHFFFAOYSA-N
ID: 32775
SMILES:Oc1cc2c(cc1C(CC(CC)C)C(C=C(C)C)C1(C)OCC(C)C1C)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 508.787
CB1 binding score: -13.613
InChIKey:AMSRTJZNAFPAIY-UHFFFAOYSA-N
ID: 32776
SMILES:CC12C(O)CC3C(C)(C)Oc4c(c(O)c(C(=O)OC)c(CCCCC)c4O)C3C1C(=C)CCC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 472.622
CB1 binding score: -17.563
InChIKey:YDINCJGDPBIHDJ-UHFFFAOYSA-N
ID: 32777
SMILES:C(C1(C)C(c2c(O)cc(CCC)cc2O)OC2(C)C1(C)CC1C=CC3C1(C(C)=C2)C3(C)C)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.635
CB1 binding score: Not available
InChIKey:FMCSRJRXHTWOQO-UHFFFAOYSA-N
ID: 32778
SMILES:C1(C)(C)C2C(C=C(C)CC2)c2c(cc(OC)cc2)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.687
InChIKey:UHTAHYZTMUZEEI-UHFFFAOYSA-N
ID: 32779
SMILES:C(C)(C)=C1C2C(CCC(COC(=O)C)=C3C(OC(c4ccccc4)=O)CC(C)(O3)C2)C(C)(C)Oc2c1c(O)c(C(=O)CC(C)C)c1c2C=CC(C)(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 726.907
CB1 binding score: -15.058
InChIKey:YCVWRVCKBLDRBW-UHFFFAOYSA-N
ID: 32780
SMILES:c1c(CCCCC)cc2c(c1O)C(=O)c1c(O)c3c(c(C)c1C2C)OC(C)(C)C1CCC(C)=CC31
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 474.641
CB1 binding score: -17.148
InChIKey:BVUBQCLLTLDENA-UHFFFAOYSA-N
ID: 32781
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1(C(CCO)C(C)C(C)C1=O)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -15.796
InChIKey:BWLQEAJVECXURW-UHFFFAOYSA-N