ID: 125728
SMILES:C1(C)(CCC(O)=O)c2c(cc(CCCCC)cc2O)OC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: -15.696
InChIKey:YZWFCZSGMRLLOL-UHFFFAOYSA-N
ID: 125729
SMILES:C(CC(C)=CCc1c(O)cc(CCC)cc1O)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -19.824
InChIKey:YJYIDZLGVYOPGU-UHFFFAOYSA-N
ID: 125730
SMILES:C(c1c(O)c2c(cc1CCCCC)OC(C)(C)C1CCC(C)(O)C=C12)CCCCCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.711
CB1 binding score: -12.905
InChIKey:VSAFHQLKZAKATJ-UHFFFAOYSA-N
ID: 125731
SMILES:O1C(=O)C(C)CC1c1c(O)cc(CCCCC)cc1OC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.375
CB1 binding score: -16.43
InChIKey:NHAILESUBKOVBM-UHFFFAOYSA-N
ID: 125732
SMILES:C1C(C(C)=C)C(c2cc(CCCCC)ccc2O)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.247
InChIKey:IJXLDZIYGDHKBA-UHFFFAOYSA-N
ID: 125733
SMILES:CCCCCc1cc(O)cc(O)c1C1CC(C)=CC=C1C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.795
InChIKey:NTSBXIIMDGIAAG-UHFFFAOYSA-N
ID: 125734
SMILES:C12CC(C(C)(C)O)(O)C1(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: Not available
InChIKey:NFVYCKVMKYTDTG-UHFFFAOYSA-N
ID: 125735
SMILES:CC1=CC(=O)C(C(C)=C)C(c2cc(CCCCC)cc(OC)c2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -13.881
InChIKey:IDGCXILMHXVPJO-UHFFFAOYSA-N
ID: 125736
SMILES:O=C1c2c(O)cc(CCCCC)cc2OC(C)(C)C2CCC(=C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -18.344
InChIKey:HXKYFXOPUYNBGA-UHFFFAOYSA-N
ID: 125737
SMILES:C(=O)(OC)COc1cc(CCCCC)cc2c1C1(O)C(C(C)(C)O2)CCC2(O)C1=CC(C)(C)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 486.605
CB1 binding score: -15.77
InChIKey:BLKPAPYZPPDBOH-UHFFFAOYSA-N
ID: 125738
SMILES:C1CC(=O)OC(CO)(C)C1Cc1c(O)cc(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 308.374
CB1 binding score: -11.441
InChIKey:YBNCVEQZWCKMPV-UHFFFAOYSA-N
ID: 125739
SMILES:CC12C=CC(C)(C)CC1c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -16.527
InChIKey:UQOTYZOBFRGMTG-UHFFFAOYSA-N
ID: 125740
SMILES:c1cc(CCCCC)cc2c1C1C(CCC1(C)C)C(C)(CCC=C(C)C=O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -15.792
InChIKey:ZHDHKLRIDALWPO-UHFFFAOYSA-N
ID: 125741
SMILES:C1CC(O)(C)CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -16.603
InChIKey:JBMMJATZNZAWFI-UHFFFAOYSA-N
ID: 125742
SMILES:C1C=CC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.675
InChIKey:UVOJDINPIJWLRK-UHFFFAOYSA-N
ID: 125743
SMILES:CC(CCC(C(=C)C)c1c(OC(=O)C)c(O)c(C2C(C(=C)C)CCC(C)=C2)cc1OC)(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.623
CB1 binding score: -13.452
InChIKey:QEUHNBLQRXGVCG-UHFFFAOYSA-N
ID: 125744
SMILES:C12C(=O)c3c(C)coc3CC1(C)CCC2(C)Oc1cc(CCCCC)cc2c1OC(C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.63
CB1 binding score: -12.407
InChIKey:SWQHKEIIWDQFHF-UHFFFAOYSA-N
ID: 125745
SMILES:c1(C)c2c(c(OC)c(OC)c1)C(C=C(C)C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.527
CB1 binding score: -13.162
InChIKey:VOTIJUXEUDCVSW-UHFFFAOYSA-N
ID: 125746
SMILES:c1c(CCCCC)cc(O)c2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.438
InChIKey:NKPBIUKTNLMNFS-UHFFFAOYSA-N
ID: 125747
SMILES:C(O)(CC(C)=CCc1c(O)cc(CCCCC)cc1O)C(C)(C=C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -15.674
InChIKey:OTAVJJQMOUVVGT-UHFFFAOYSA-N
ID: 125748
SMILES:C1C2(C)C3(Oc4c(cc(O)cc4CCCCC)C3)C(=O)OC2CC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -14.793
InChIKey:LJZQENJLMBQTFZ-UHFFFAOYSA-N