ID: 119827
SMILES:C(CCCCc1c(O)c2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -14.675
InChIKey:JAYDPXDQYXCXHV-UHFFFAOYSA-N
ID: 119828
SMILES:COc1c(CO)c(C=C(CO)OC)c2c(c1O)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.476
CB1 binding score: -14.21
InChIKey:TXQPVBVSFRPSKX-UHFFFAOYSA-N
ID: 119829
SMILES:c12c(cc(CCCCC)cc1OC)OC(C)(C)C1CCC(C)(O)C(O)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -17.791
InChIKey:WKGFZDRQLNVRRQ-UHFFFAOYSA-N
ID: 119830
SMILES:Oc1c(O)c2c(cc1CCCCC)OC(C)(C)C1CCC(C)CC21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.388
InChIKey:RRFGBNZCKQNCSH-UHFFFAOYSA-N
ID: 119831
SMILES:C1C(C(=C)C)C(c2c(O)cc(CCCCC)cc2O)C(C(C)=C)C2C=C(C(OC)=O)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.635
CB1 binding score: -11.814
InChIKey:UKJCOMNBFPSDQZ-UHFFFAOYSA-N
ID: 119832
SMILES:Oc1c(C)cc2c(c1)C1C(C(C)(C)O2)CCC(C)=CC1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Bisabolane sesquiterpenoids;Cannabinoids
MW: 302.414
CB1 binding score: -13.308
InChIKey:LYHQEYLADBQJJH-UHFFFAOYSA-N
ID: 119833
SMILES:C12CC3c4c(O)cc(CCC(OC)=O)cc4OC(C)(C)C3C1OC(=O)C2=C
Pathway: Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cannabinoids;Guaiane sesquiterpenoids
MW: 372.417
CB1 binding score: -14.993
InChIKey:TWMKCHKDUAILTB-UHFFFAOYSA-N
ID: 119834
SMILES:CCOc1c2c(cc(C)c1OC)C=CC(C)(CCC=C(C)C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -12.285
InChIKey:PZMBYVAROXIGTD-UHFFFAOYSA-N
ID: 119835
SMILES:C1C2=CC(c3c(O)ccc(CCCCC)c3)C(C1(C)C)OC2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -15.501
InChIKey:UJEBQBZASBALGQ-UHFFFAOYSA-N
ID: 119836
SMILES:c1(CN)cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CCC1C2(O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 331.456
CB1 binding score: -15.714
InChIKey:ZTIMBAHOYVDNJX-UHFFFAOYSA-N
ID: 119837
SMILES:Oc1c(C2C(C(C)=C)CC(=O)C(C)C2)c(O)cc(CCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -15.612
InChIKey:YPAMBGFQWVQHCZ-UHFFFAOYSA-N
ID: 119838
SMILES:C(c1cc(CCCCC)cc2c1C1C(C(C)(C)O2)CCC(C)=C1)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.578
CB1 binding score: -16.995
InChIKey:UKWMTFBMUQQDJH-UHFFFAOYSA-N
ID: 119839
SMILES:c1(O)c(OC)c(OC)cc2c1-c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.461
CB1 binding score: -18.198
InChIKey:UITRNYMNEDMFBJ-UHFFFAOYSA-N
ID: 119840
SMILES:c1(O)cc(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: 119841
SMILES:C1(C)=CC(c2c(O)ccc(C#C)c2)C(C(C)=C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 252.357
CB1 binding score: -15.403
InChIKey:LAIZOXDXJGLQSK-UHFFFAOYSA-N
ID: 119842
SMILES:c12ccc(C)cc1-c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 119843
SMILES:c1(O)c(C(C(C)CC)=O)c(O)c2c(c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.716
InChIKey:IUMSZUVURMSVLI-UHFFFAOYSA-N
ID: 119844
SMILES:c12ccc(O)cc1C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -20.067
InChIKey:OBJJEVJNCDBGOD-UHFFFAOYSA-N
ID: 119845
SMILES:C1CC(C)=CC(c2c(O)cc(CCCCC)cc2O)C1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 119846
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1C(C)(CCC1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -16.876
InChIKey:OYVJRUGQLQWOSA-UHFFFAOYSA-N
ID: 119847
SMILES:C1=C(C)CCC(C(C)(O)C)C1c1c(O)c(C(=O)C(CC)C)c(CC(CCC=C(C)C)C)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.694
CB1 binding score: -16.303
InChIKey:RLTWNSGBIHSPSC-UHFFFAOYSA-N