ID: 98701
SMILES:C1C(C(C)=C)C(c2c(O)cc(CCCCC)cc2)CC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -16.481
InChIKey:YGQOYJUFZSNESF-UHFFFAOYSA-N
ID: 98702
SMILES:c1(CCCC)cc(OC)c(C2C=C(C(O)=O)CCC2C(=C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -14.041
InChIKey:QZGPOBJZMLXVIV-UHFFFAOYSA-N
ID: 98703
SMILES:C1CC(C)=CC2C1C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 98704
SMILES:C(C(c1cc(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)c1)C)(O)C(=C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.74
InChIKey:RAYJWFCWRMONQJ-UHFFFAOYSA-N
ID: 98705
SMILES:CC1(CC(=O)OC)CCC2C(C)(C)Oc3cc(CCCCC)c(C(=O)O)c(O)c3C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.53
CB1 binding score: -14.489
InChIKey:HVNJWEJNKZMBGO-UHFFFAOYSA-N
ID: 98706
SMILES:C1(CC(C)(C)C)Oc2c(c(O)cc(C)c2)C2C=C(C)CCC2C(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -13.713
InChIKey:SFGSKRWEESEVRI-UHFFFAOYSA-N
ID: 98707
SMILES:CC1(C)Oc2c(ccc(C)c2)C2C(O)CC(C)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -17.703
InChIKey:NCKZVDCUOPRLFZ-UHFFFAOYSA-N
ID: 98708
SMILES:C1C2C(C)(C)Oc3c(c(O)cc(CCCC)c3)C2C=C(C(OC)=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.334
InChIKey:IVOMNWVMBRMVJJ-UHFFFAOYSA-N
ID: 98709
SMILES:C12(C(C)(C)CCC(=O)C1C)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.374
InChIKey:OGRXOLICYABIFM-UHFFFAOYSA-N
ID: 98710
SMILES:c1(CCC(=O)C)cc(O)c2c(c1)OC(CCC=C(C)C)(C)C=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -18.206
InChIKey:UUZPMJGKYCRKLU-UHFFFAOYSA-N
ID: 98711
SMILES:C(Cc1cc(OC)c2c(c1)OC(C)(C)C1(O)C(O)CC(C)CC21)CC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -15.815
InChIKey:CVEHVTGBYSMIKY-UHFFFAOYSA-N
ID: 98712
SMILES:c1(=O)c(OC)c(CCCCC)cc(OC)c2c1OC1(C)CCC3C(C)(C)CC2C31
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -15.857
InChIKey:JNMMSBADPSERFK-UHFFFAOYSA-N
ID: 98713
SMILES:O(C(c1c(O)cc2c(c1)OC(C)(C)C1CC=C(C)CC21)C(CCCc1ccoc1)=O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.537
CB1 binding score: -15.71
InChIKey:AVIDCPUREIZQDW-UHFFFAOYSA-N
ID: 98714
SMILES:CC1=CC2C(C(C)(C)Oc3cc(C)c(O)cc32)CC1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Miscellaneous meroterpenoids
MW: 272.344
CB1 binding score: -17.952
InChIKey:CLFHOLPMPFYSHV-UHFFFAOYSA-N
ID: 98715
SMILES:C1(C)=CC2C(C(C)(C)Oc3c2c(OC)c(OC)c(OC)c3)CC1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.396
CB1 binding score: -15.592
InChIKey:MTHNZSKAJVJXRD-UHFFFAOYSA-N
ID: 98716
SMILES:O=C1C2(C)C3C(C)(CCC2C(C)(C)CC1)c1c(cc(CCC)cc1O)O3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -17.267
InChIKey:WXSDXLCCLCUJSA-UHFFFAOYSA-N
ID: 98717
SMILES:C1CC(C(C)C)C(c2c(OC)cc(CCCCC)cc2)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.513
CB1 binding score: -17.403
InChIKey:CPVCFJQAAQSIRB-UHFFFAOYSA-N
ID: 98718
SMILES:C1(C)=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: 98719
SMILES:C1=C(C)CCC(C(C)C)C1c1c(O)cc(CC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -18.748
InChIKey:LLAAZDYTZYGRPH-UHFFFAOYSA-N
ID: 98720
SMILES:C1C(O)C(=O)C2=C1C(C)(C)Oc1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.396
CB1 binding score: -13.389
InChIKey:HQIBQIDQGMOYTC-UHFFFAOYSA-N
ID: 98721
SMILES:CC(=CCC12c3c(cc(CCCCC)cc3O1)OC(C)(C)C(O)C2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -12.219
InChIKey:PTLBDQFZHFFJBP-UHFFFAOYSA-N