ID: 71716
SMILES:Cc1c(-c2c(O)cc3c(c2)OC(C)(C)C2C3CC(C)=CCC2)cc(O)c(CC=C(C)C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.603
CB1 binding score: -13.936
InChIKey:DYMBXJDATRVSOU-UHFFFAOYSA-N
ID: 71717
SMILES:C1(O)C(O)C(CO)OC(Oc2c(CC=C(CCC=C(C)C)C)c(O)cc(CCCCC)c2)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 478.626
CB1 binding score: -17.906
InChIKey:XQGPGGGCAICGJC-UHFFFAOYSA-N
ID: 71718
SMILES:Oc1cc(CCCCC)cc2c1C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 71719
SMILES:c1(O)cc(C)c(C2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.798
InChIKey:KDZOUSULXZNDJH-UHFFFAOYSA-N
ID: 71720
SMILES:C12C(OC)(c3c(cc(CCCCC)c(C(=O)Oc4ccc(OCCCCC)cc4)c3O)OC1(C)C)CC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Depsides
MW: 536.709
CB1 binding score: -16.876
InChIKey:AJIWKVVJKYCBHT-UHFFFAOYSA-N
ID: 71721
SMILES:C(CCC(C)=CCc1c(O)cc(CCc2ccccc2)cc1O)C=C(CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.648
CB1 binding score: -12.954
InChIKey:AIASNDARDDKGCH-UHFFFAOYSA-N
ID: 71722
SMILES:c1(O)cc(C2C=C(C)CCC2C(C)=C)c2c(c1)OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.556
CB1 binding score: -16.502
InChIKey:WTDATLMYIBPOKR-UHFFFAOYSA-N
ID: 71723
SMILES:c1(O)ccccc1C1C=C(C)CCC1C(C)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 228.335
CB1 binding score: -18.767
InChIKey:FFUBTKRHDZNPRU-UHFFFAOYSA-N
ID: 71724
SMILES:C1CC(CCC(O)C(=C)C)(C)Oc2c1c(O)cc(CCCCC)c2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.116
InChIKey:IXTRQPLACLOMMU-UHFFFAOYSA-N
ID: 71725
SMILES:C(CCC)Cc1cc2c(c(O)c1C(=O)C(C)C)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -16.408
InChIKey:AEJMRAWXFUCXKD-UHFFFAOYSA-N
ID: 71726
SMILES:C1(O)C(O)C(OC2C(C)=CCC3C(CO)(C)Oc4cc(CCCCC)cc(O)c4C3C=C(C)C2)OC(CO)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 562.7
CB1 binding score: -14.461
InChIKey:DICVICICYXZTIP-UHFFFAOYSA-N
ID: 71727
SMILES:CC(CC(c1cc(C)c2c(c1)OC(C)(C)C1CCC(C)=CC21)OC(C)=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -13.839
InChIKey:LRLCFLDJZJDLRA-UHFFFAOYSA-N
ID: 71728
SMILES:C1C2(C)C3(O)C(OC(=O)C3C1)c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.396
CB1 binding score: -15.787
InChIKey:BCDBDZCKWBLCIU-UHFFFAOYSA-N
ID: 71729
SMILES:O=C1c2c(COc3c(O)cc(CCCCC)cc3O)OC(C)(C)C3CCC(C)(CC1)C23
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.569
CB1 binding score: Not available
InChIKey:DFDAMUWHLZAVDD-UHFFFAOYSA-N
ID: 71730
SMILES:C1C2(C)Oc3cc(CCCCC)cc(O)c3C3C2C(C(C)C1)C3(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -14.922
InChIKey:CUWGYHBQEOROSW-UHFFFAOYSA-N
ID: 71731
SMILES:C1C2C(C)(C)Oc3c(c(O)cc(CCCCCCC)c3O)C2C2CCC(C(=O)C)C2(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.667
CB1 binding score: -12.209
InChIKey:NVFALOPQLIQAMV-UHFFFAOYSA-N
ID: 71732
SMILES:C1C(C(C)=C)C(c2c(O)cc(CCCCC)c(O)c2)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.048
InChIKey:FUZJMTMPVZRGQF-UHFFFAOYSA-N
ID: 71733
SMILES:CC1(CCCC(O)(C)C)Oc2c(c(O)cc(CCC)c2)C(=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: -14.204
InChIKey:LCNKHUMECGTBBM-UHFFFAOYSA-N
ID: 71734
SMILES:CC1CCC2C(C)(Oc3c(c(O)cc(CCCCC)c3)C2O)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -14.717
InChIKey:FEBCUSPYPHASCF-UHFFFAOYSA-N
ID: 71735
SMILES:C1(C(=O)O)C=C2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -14.639
InChIKey:NRFPJUAYMOOVFM-UHFFFAOYSA-N
ID: 71736
SMILES:C(C)CCCCc1cc2c(c(O)c1)C1C3C(C)(C)C(=O)C(C)(C)C3C1C(=O)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -12.256
InChIKey:SMGVGCYUVQFBGV-UHFFFAOYSA-N