ID: 96853
SMILES:CC1(C)C2CC=C(C(=O)O)CC2c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.707
InChIKey:OGXXAQFMAFTSRU-UHFFFAOYSA-N
ID: 96854
SMILES:CCCCCc1cc2c(c(O)c1C=O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -17.972
InChIKey:XMFATGXZFZMSFO-UHFFFAOYSA-N
ID: 96855
SMILES:Oc1cc(CCCCC)c(O)c2c1C1C(O)C3(C(OCC)OC(C)(C)C3C1)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.547
CB1 binding score: -15.649
InChIKey:JBWZLUOIASGGTA-UHFFFAOYSA-N
ID: 96856
SMILES:CC1(O)C(OC(=O)C)C2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -17.069
InChIKey:PAEIGIJJBBPJFT-UHFFFAOYSA-N
ID: 96857
SMILES:c1c(C)c(C2C(C(=C)C)CC(O)C(C)=C2)c(O)c(C(O)=CC(=O)C(C)C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -17.496
InChIKey:SBLYIEDNGMNSDH-UHFFFAOYSA-N
ID: 96858
SMILES:C1(C)=CC2C(C(C)(C)Oc3cc(O)c(CC=C(C)C)c(O)c32)CC1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -16.456
InChIKey:ASOOWBPMFGBNBQ-UHFFFAOYSA-N
ID: 96859
SMILES:C1(C=C(C)C)c2c(c(O)cc(CCCCC)c2O)CC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -15.674
InChIKey:KCTRCWKDXIOYNO-UHFFFAOYSA-N
ID: 96860
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C(C(=C)C)CCC1(C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.497
CB1 binding score: -17.596
InChIKey:RWFIRVYASWVANS-UHFFFAOYSA-N
ID: 96861
SMILES:C1C2(C)CCC3C(C)(C)Oc4cc(CCCCC)cc(O)c4C1C2C(C)(O)C=C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -16.098
InChIKey:HUTYKNSUGZMPBT-UHFFFAOYSA-N
ID: 96862
SMILES:CC(CCC=C(C)C)=CCc1c(O)c(C)cc(OC(C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -16.427
InChIKey:NYISEVXKNRBCFO-UHFFFAOYSA-N
ID: 96863
SMILES:C1(Cl)C2(C)CCC(C(C)=C)C(c3c(O)cc(CCCCC)cc3O1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.941
CB1 binding score: -16.508
InChIKey:WHMFAHJYWBFNLH-UHFFFAOYSA-N
ID: 96864
SMILES:c1(O)c2c(cc(CCCCC)c1Cl)OC(C)(C)C(O)Cc1c-2c(O)cc(C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.934
CB1 binding score: -17.706
InChIKey:JZNHBUOBJIZYFK-UHFFFAOYSA-N
ID: 96865
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2=C(C(=O)C(O)=C1C(C)C)C(=O)C(OC)=C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.536
CB1 binding score: -15.929
InChIKey:IMHJXJUUDGHPFY-UHFFFAOYSA-N
ID: 96866
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C(C(O)(C)C)CCC(O)(C1)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -14.821
InChIKey:LKGDGBFHKXQFDP-UHFFFAOYSA-N
ID: 96867
SMILES:C1CC(C(C(O)=O)C)C2(Cc3c(O)cc(CCCCC)cc3O2)C1(C)C=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -13.756
InChIKey:NVOOUWLZERQYMI-UHFFFAOYSA-N
ID: 96868
SMILES:CCCCCc1cc2c(cc1)C(CCC=C(C)C)(C)OC2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -14.051
InChIKey:RBHDKPBVCUSHIN-UHFFFAOYSA-N
ID: 96869
SMILES:C(CCCCC)C(C)c1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -16.687
InChIKey:PRRVKKZIEQODHE-UHFFFAOYSA-N
ID: 96870
SMILES:C(=C)(C)C1CCC(C)=CC1c1c(O)ccc(O)c1C(=O)CC(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.546
InChIKey:BCVSBOBNOXNSAK-UHFFFAOYSA-N
ID: 96871
SMILES:O(c1c2c(c(C(CCCC)=O)cc1)OC(C)(C)C1CCC(C(O)=O)=CC21)c1ccccc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.532
CB1 binding score: -17.055
InChIKey:HVGUJFUZXBCPKU-UHFFFAOYSA-N
ID: 96872
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 96873
SMILES:C1(C)(C)C2C(c3c(O)cc(CCCCC)cc3O2)C2C(C)(CC1)CCC1(C)C(O)C(=C(O)C(C)C)C(=O)C3OC213
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 552.752
CB1 binding score: -14.886
InChIKey:HHVQHIOXFAAHHY-UHFFFAOYSA-N