ID: 38641
SMILES:Oc1cc2c(c(O)c1C(C(C)=CCC=C(C)C)CO)OC(C)(C)C1CCC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -14.041
InChIKey:RQJDOVQFBGVJDE-UHFFFAOYSA-N
ID: 38642
SMILES:CNCCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C(O)=O)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 331.412
CB1 binding score: -14.934
InChIKey:MWUJBJWUMYNZJJ-UHFFFAOYSA-N
ID: 38643
SMILES:C1(CCC(C)C)C(C)(C)Oc2c(c(OC(=O)C)cc(CCCCC)c2)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.537
CB1 binding score: -14.888
InChIKey:PFYYGVADJGFROW-UHFFFAOYSA-N
ID: 38644
SMILES:C1C(C)(C)C2C(C)(CC1)Oc1c(c(O)cc(CCCC)c1)C2C=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.254
InChIKey:XAFDRXUGEMCWKT-UHFFFAOYSA-N
ID: 38645
SMILES:C1=CC(C)(C)Oc2c1c(O)cc(CCCCC)c2OC(C=C(C)C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.999
InChIKey:QNJJYNLYAZUUNO-UHFFFAOYSA-N
ID: 38646
SMILES:CC1=CC2C(C(C)(C)Oc3c(C(=O)C(CC)C)cc(OC)c(C)c32)CC1(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -13.094
InChIKey:IHFQYQBVMOHWKQ-UHFFFAOYSA-N
ID: 38647
SMILES:C1(O)C(C)(C)C2C(C)(Oc3c(c(OC)cc(CCCCC)c32)C=CC(O)(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: Not available
InChIKey:AJQINQINKFWMAU-UHFFFAOYSA-N
ID: 38648
SMILES:CC1(C)C2C1CC(=O)C1=C(C2)C(C)(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -16.156
InChIKey:OHSTXBRFJHNMTF-UHFFFAOYSA-N
ID: 38649
SMILES:C(CCc1cc2c(c(O)c1C(=O)CC(C)C)OC(C)(C)C1CCC(C)=CC12)CC(C)=CCCO
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.678
CB1 binding score: -15.77
InChIKey:JIBHEULEZVHWTE-UHFFFAOYSA-N
ID: 38650
SMILES:C12(C)Oc3cc(O)cc(CCC)c3CC1C(C(CO)C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -14.215
InChIKey:FHMYFBAIDHZPTO-UHFFFAOYSA-N
ID: 38651
SMILES:C1=CC2(C)Oc3c(c(O)cc(C)c3)C(=O)C2CC=C1CCCC(O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -15.98
InChIKey:VJQCJBJRQBBOTP-UHFFFAOYSA-N
ID: 38652
SMILES:C1(C(C)C)C2(CCC(=O)C)Oc3c(c(O)cc(CCCCC)c3)C(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -12.595
InChIKey:WWZUPSLQQCMKIA-UHFFFAOYSA-N
ID: 38653
SMILES:C(C(c1ccc2c(c1O)OC(C)(C)C1CCC(C)=CC21)C)CC(C(CCC=C(C)C)=C)CCO
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.706
CB1 binding score: -15.374
InChIKey:GSTXGHCODNFSHK-UHFFFAOYSA-N
ID: 38654
SMILES:C12C(C)(C)Oc3c(c(O)cc(CCCCC)c3-c3cc(O)c(O)c(CCc4ccccc4)c3)C1CC=C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 526.717
CB1 binding score: -18.362
InChIKey:FTDQHSJDPRKYBK-UHFFFAOYSA-N
ID: 38655
SMILES:C(CCCCCc1cc2c(c(O)c1)C1C=C(CO)CCC1C(C)(C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -17.209
InChIKey:VPDBCGRUZCACNK-UHFFFAOYSA-N
ID: 38656
SMILES:C(C(O)(C)C)CCC(C)=CCc1c(O)cc(CCc2ccccc2)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -17.011
InChIKey:UNZYAXFMIZROQJ-UHFFFAOYSA-N
ID: 38657
SMILES:c1(CCCCC)cc2c(c(O)c1)C1CC(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 38658
SMILES:C(C=C(CCC=C(CC)C)C)c1c(O)c(C(=O)O)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 374.521
CB1 binding score: -15.813
InChIKey:XRRHJYCVLFXRCP-UHFFFAOYSA-N
ID: 38659
SMILES:CC1C2=CC(=O)C(C)=CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.409
CB1 binding score: -15.907
InChIKey:VZZJIDJWGDLZNG-UHFFFAOYSA-N
ID: 38660
SMILES:C(CCC)Cc1cc2c(c(OC)c1)C1OC=C(C)C3C(C)(CCC3C(C)(C)O1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -13.656
InChIKey:USZALPAXRMADMI-UHFFFAOYSA-N
ID: 38661
SMILES:C1(C(C)C)C(c2c(O)cc(CC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -18.748
InChIKey:LLAAZDYTZYGRPH-UHFFFAOYSA-N