ID: 76693
SMILES:C1(=O)C(C)=CC2C(c3c(cc(CCCCC)cc3O)O2)C1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -15.43
InChIKey:YXLNJEXPKZGUSV-UHFFFAOYSA-N
ID: 76694
SMILES:C1C(C)C(=C)C(C)(CCC(C)=CCc2c(O)cc(CCCCC)cc2O)C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Diterpenoids
Class: Cannabinoids;Cyclophytane diterpenoids
MW: 398.631
CB1 binding score: -13.356
InChIKey:NCERIAFEAMMKAA-UHFFFAOYSA-N
ID: 76695
SMILES:CC1(C)C2CCC(C)CC2c2c(cc(CCCCCO)cc2O)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -15.91
InChIKey:ZYIULORQQXMGIH-UHFFFAOYSA-N
ID: 76696
SMILES:O=C(C)OC1C2C(C)(CCC13C(C)(OC)C(=O)C=C(OC(C)=O)C3C)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 542.669
CB1 binding score: -14.816
InChIKey:SXBPSJZCMJLTSA-UHFFFAOYSA-N
ID: 76697
SMILES:O=C(Oc1c2c(cc(CCCCC)c1)OC(CCC=C(C)C)(C)C1CCC(C)=CC21)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.652
CB1 binding score: -13.709
InChIKey:JULCXDZHOIVLRW-UHFFFAOYSA-N
ID: 76698
SMILES:C1(C)C2CC(O)(C(C)(C)Oc3cc(CCCCC)c(O)c(O)c32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -15.6
InChIKey:JTCOOXOXZNSCJV-UHFFFAOYSA-N
ID: 76699
SMILES:C(=C1CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1)C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -14.993
InChIKey:ZUZLTPYYMVHXNM-UHFFFAOYSA-N
ID: 76700
SMILES:C1CCC(C)CC1c1c(O)cc(CCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -16.698
InChIKey:AHWLHRMXBSQUEW-UHFFFAOYSA-N
ID: 76701
SMILES:c12c3c(ccc1C)-c1c(cc(CCCCC)cc1O)OC3(C)CCC(O)C2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.555
CB1 binding score: -15.633
InChIKey:HURLQCPGEJDNMP-UHFFFAOYSA-N
ID: 76702
SMILES:O1C2(c3c(cc(CCCCC)cc3O)OC2(C)C)C(=O)c2c(OC)c(O)c(C)cc21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.482
CB1 binding score: -17.138
InChIKey:CPBIXNQGEKMOOK-UHFFFAOYSA-N
ID: 76703
SMILES:C1C(C)=CCCC(C)=CCc2c(O)cc(CCCCCCCC)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.551
CB1 binding score: -16.334
InChIKey:AOEARQRONMSJDP-UHFFFAOYSA-N
ID: 76704
SMILES:CC(OC1C2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CCC1(C)O)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -17.069
InChIKey:PAEIGIJJBBPJFT-UHFFFAOYSA-N
ID: 76705
SMILES:C(C=CCC(C)=CCc1c(O)c(C)cc(O)c1)(=C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.746
InChIKey:SAVHMKMRPFLBRI-UHFFFAOYSA-N
ID: 76706
SMILES:C(Cc1cc(O)cc(CC=C(CCC=C(C)C)C)c1)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -16.831
InChIKey:YZQMXXBVTXPSRM-UHFFFAOYSA-N
ID: 76707
SMILES:Oc1cc(CCCC)cc2c1C1=C(C(C)C)CCC(C)C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 352.562
CB1 binding score: -16.375
InChIKey:HCOPOIRJKHCSCC-UHFFFAOYSA-N
ID: 76708
SMILES:C1C(Br)C(C)(C)CC2(c3c(cc(CCCCC)cc3O)OC2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 381.354
CB1 binding score: -14.385
InChIKey:DHVKGNQJSAJOLZ-UHFFFAOYSA-N
ID: 76709
SMILES:C12C(C(C)CC3(O)C(C(C)(O)C)C(C)(C13)Oc1c(C(OC)=O)c(O)cc(CCCCC)c1)CC(C)=C2
Pathway: Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 500.676
CB1 binding score: -15.116
InChIKey:LJDILCUPAUXYRN-UHFFFAOYSA-N
ID: 76710
SMILES:C(C1=CC2C(C=C1)C(C)(C)Oc1c2c(O)cc(CCCCCC)c1)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -14.869
InChIKey:CVSDIEFDBGMSCP-UHFFFAOYSA-N
ID: 76711
SMILES:C(CCCCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2)CCCCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.658
CB1 binding score: -18.429
InChIKey:YCRMKVLKKBTFTH-UHFFFAOYSA-N
ID: 76712
SMILES:C1=CC(C)(CCC=C(C)CCC(C(C)(C)O)O)Oc2c1c(O)cc(C(C)O)c2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -15.652
InChIKey:SCDRRYLZZVUYTE-UHFFFAOYSA-N
ID: 76713
SMILES:CC1=CCCC(C)=CC(=O)c2c(cc(CCCC)cc2O)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -16.739
InChIKey:XTDXVTVPVPDYRK-UHFFFAOYSA-N