ID: 45760
SMILES:C(OC)(C1=CC2C(C(C)(C)Oc3cc(C)ccc32)CC1)=O
Pathway: Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Bisabolane sesquiterpenoids;Cadinane sesquiterpenoids;Cannabinoids
MW: 286.371
CB1 binding score: -16.643
InChIKey:QOLHAOFHGNABPR-UHFFFAOYSA-N
ID: 45761
SMILES:c1(CCCCC)cc(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: 45762
SMILES:C(CC)CCc1cc(O)c2c(c1)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 45763
SMILES:C(CCCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1)C(=O)c1ccccc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.55
CB1 binding score: Not available
InChIKey:KQOAJRDALRXFAR-UHFFFAOYSA-N
ID: 45764
SMILES:C1(C(C)=C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 45765
SMILES:C123CC(CC1)C2c1c(cc(CCCCC)cc1O)OC3(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -16.323
InChIKey:JJHUGSGHUIAQQZ-UHFFFAOYSA-N
ID: 45766
SMILES:C1(CC[CH]C2(C)CO2)(CO)Oc2c(cc(CCCCC)cc2O)CC1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 361.502
CB1 binding score: -14.084
InChIKey:JWEPEACVLSCVTK-UHFFFAOYSA-N
ID: 45767
SMILES:c1cc(O)cc2c1OC(C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -20.067
InChIKey:OBJJEVJNCDBGOD-UHFFFAOYSA-N
ID: 45768
SMILES:C1(Oc2c(CC=C(C)C)c(O)cc(CCCCC)c2)C(O)C(O)C(O)C(CO)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.507
CB1 binding score: -17.229
InChIKey:DEJBVDPQQDKBBA-UHFFFAOYSA-N
ID: 45769
SMILES:CC1(CCC=C(C)C)Oc2c(c(O)cc(CCCCC)c2)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 45770
SMILES:C1C2C(C)(C)C3C1c1c(O)cc(CCCCC)cc1OC3(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -14.463
InChIKey:FHPYNDPMNHNAPT-UHFFFAOYSA-N
ID: 45771
SMILES:C(CCCCCCCCCCCCCc1c(OC)cc2c(c1)OC(c1c(O)c(CC=C(C)C)c(O)c(CC=C(C)C)c1)C(C)(O)C2)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 648.969
CB1 binding score: -17.247
InChIKey:OPVWYVJKDSZRMK-UHFFFAOYSA-N
ID: 45772
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 45773
SMILES:C12(C)CCCC1(C)Oc1c(c(O)cc(C)c1-c1c(O)cc(CCCCC)cc1O)C2C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.646
CB1 binding score: -14.094
InChIKey:RUPFRHJFFOSTHI-UHFFFAOYSA-N
ID: 45774
SMILES:C(CCCC)Cc1cc2c(c(O)c1O)C1C(C(C)(C)O2)CC=C(C=C)C1C(C=C(C)C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.608
CB1 binding score: -14.69
InChIKey:QVNCYUBEESEZMQ-UHFFFAOYSA-N
ID: 45775
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CC(O)C(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.534
InChIKey:INKUWBOHCFHXTJ-UHFFFAOYSA-N
ID: 45776
SMILES:C1C(C)=CC2c3c(cc(C)c([O-])c3O)OC(C)(C)C2C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 273.352
CB1 binding score: -14.805
InChIKey:BDJDGHAJUAVGBE-UHFFFAOYSA-M
ID: 45777
SMILES:CC(=CC1c2c(O)cc(CCCCC)cc2OC(C)(C)C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -17.334
InChIKey:LKJNAKRLOPZHAJ-UHFFFAOYSA-N
ID: 45778
SMILES:C1(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 45779
SMILES:C(CC)CCCc1cc2c(c(O)c1)C1C(CC=C(C)C1)C1(C)CCC(C(C)(C)O)OC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.641
CB1 binding score: -11.587
InChIKey:NIARMQDCAUUKPL-UHFFFAOYSA-N
ID: 45780
SMILES:C(CCO)Cc1cc2c(c(O)c1)C1C=C(C(O)=O)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.423
CB1 binding score: -15.552
InChIKey:FUAJDJIQBRVZGF-UHFFFAOYSA-N