ID: 86836
SMILES:O(c1c(O)cc(O)c2c1C1C=C(CO)CCC1C(C)(C)O2)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.358
CB1 binding score: -14.021
InChIKey:LZAAMSMAMGKKOD-UHFFFAOYSA-N
ID: 86837
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(CCC=C(C)C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.002
InChIKey:ITDDKOGKAGSKEJ-UHFFFAOYSA-N
ID: 86838
SMILES:c1(CCCCCC)cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(CO)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -18.264
InChIKey:JSQZQNWIVUSPJH-UHFFFAOYSA-N
ID: 86839
SMILES:C1(C(CC2C(C(C)C)CCC2C(=O)O)=O)C(C(C)O)Oc2c1c(O)cc(CCCCC)c2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.584
CB1 binding score: -14.604
InChIKey:QYPKSCZSLQFWOS-UHFFFAOYSA-N
ID: 86840
SMILES:C(CCCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(CO)=CCC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.22
InChIKey:VCNVSFPZFOMJQW-UHFFFAOYSA-N
ID: 86841
SMILES:C(c1c2c(c(O)c(C)c1O)OC(C)(C)C1C2CC(C)=CC1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -16.289
InChIKey:ZLVOLODWIQAORA-UHFFFAOYSA-N
ID: 86842
SMILES:CC1=CC(c2ccc(CCCCC)cc2)C(C(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.487
CB1 binding score: -19.108
InChIKey:KCGRQTUOQYSEJY-UHFFFAOYSA-N
ID: 86843
SMILES:CC1(C)CC(=O)C=C2c3c(cc(CCCCC)cc3O)OC(C)(C)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -17.845
InChIKey:HAHWTSIFNGMUNV-UHFFFAOYSA-N
ID: 86844
SMILES:c1(CCCCC)cc2c(c(O)c1C=O)CC(C)(C)C1CC(C(C)=C)CCC21C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -15.467
InChIKey:WJSAFGKHQSCBCF-UHFFFAOYSA-N
ID: 86845
SMILES:C(CC=C(C1OC(C)(C)C=CC1)C)C(C)=CCc1c(O)c(C)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -11.668
InChIKey:RACZWIVEGLUJRI-UHFFFAOYSA-N
ID: 86846
SMILES:C12(C)Oc3c(c(O)c(C(=O)O)c(CCCCCC)c3)C=C1CC(C(C)(O)C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -12.323
InChIKey:IYUAILUQHSXWMV-UHFFFAOYSA-N
ID: 86847
SMILES:C(CCC(C)(O)C(C)(CCC1(C)Oc2c(c(C)cc(O)c2)CC1)O)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.471
CB1 binding score: -16.234
InChIKey:PSZLTVZUKJQNTA-UHFFFAOYSA-N
ID: 86848
SMILES:CC(=CCc1c(O)c2c(c(C(CCCCC)=O)c1O)OC(C)(C)C1CC2C(C)=CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -15.332
InChIKey:ZLINMIFNIIZQAV-UHFFFAOYSA-N
ID: 86849
SMILES:O=c1oc2cc(OCC3C4C(C(C)(C)Oc5cc(CCCCC)cc(O)c54)C3)c3c4c(cc(O)c(=O)c(C(C)C)c14)OC23
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 586.681
CB1 binding score: -14.24
InChIKey:WFZDGAQMBIJZRB-UHFFFAOYSA-N
ID: 86850
SMILES:c1c(O)cc2c(c1O)C(CC(C)C)CC1(O)C2C(C(CCC=C(C)C)C)=C(O)C(C)=C1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.596
CB1 binding score: -17.263
InChIKey:WDAGRYQNKIHAPR-UHFFFAOYSA-N
ID: 86851
SMILES:Oc1cc(CCCCC)cc2c1C1C=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: 86852
SMILES:C1(C)=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 86853
SMILES:CC(C1C(c2c(O)cc3c(c2O)C=CC(C)(CCC=C(C)CO)O3)C=C(C)CC1)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.554
CB1 binding score: -16.802
InChIKey:JMVUUGKXGPENNP-UHFFFAOYSA-N
ID: 86854
SMILES:CC1(C)OCC2(C)Oc3ccc(C(CC)OC(=O)C)c(C)c3CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -14.424
InChIKey:AWEXZJZJIXIUDI-UHFFFAOYSA-N
ID: 86855
SMILES:OC(C(C)O)Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC1O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.439
CB1 binding score: -14.605
InChIKey:LXGVMVHAGMUZFW-UHFFFAOYSA-N
ID: 86856
SMILES:C(CCCC)c1cc(O)c2c(c1C(O)=O)C=CC(C)(CCC=C(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.636
InChIKey:VKFFKPSFOREJKS-UHFFFAOYSA-N