ID: 85261
SMILES:C1CC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C=C(C)CCC(O)C1=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -17.476
InChIKey:HSWXXXXJJDRGQI-UHFFFAOYSA-N
ID: 85262
SMILES:C(C)CCCc1cc2c(c(O)c1)C1CC(CO)(C)CCC1(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -16.706
InChIKey:VBUATOUZHDGGDX-UHFFFAOYSA-N
ID: 85263
SMILES:C1C(C)=CCC2C(C)(C)Oc3c(c(OC)cc(CCCCC)c3)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -15.54
InChIKey:VILPSNYHVAJEJY-UHFFFAOYSA-N
ID: 85264
SMILES:c12c(cc(CCCC)cc1O)OC(C)(C)C1=C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -17.06
InChIKey:WQVFVTKXRBQFFH-UHFFFAOYSA-N
ID: 85265
SMILES:c1c(O)c2c(cc1CCCCCC)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 85266
SMILES:C(CCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 85267
SMILES:C1(=O)CC(C)CC(c2c(O)cc(CCCCC)cc2)C1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -12.926
InChIKey:ZGKIPBOSPMCKJT-UHFFFAOYSA-N
ID: 85268
SMILES:C1(C)=CCC2C(C1)c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 85269
SMILES:C(C(=CCCC1(C)Oc2c1c(O)cc(CCC)c2)C)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -15.706
InChIKey:IIOLZKBAKHBQII-UHFFFAOYSA-N
ID: 85270
SMILES:C=C(C)C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 85271
SMILES:CC1C2CCC(C)=CC2c2c(O)cc(CC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -15.165
InChIKey:GIANYFIYTIKLNM-UHFFFAOYSA-N
ID: 85272
SMILES:C(C(C(=C)C)=O)CC(C)=CCc1c(O)cccc1C1C=C(C)CCC1C(=C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.556
CB1 binding score: -15.104
InChIKey:MAMASOOSBSSIQP-UHFFFAOYSA-N
ID: 85273
SMILES:c1(CCC(CCC=C(C)C)C)c(O)c(C(O)=O)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 362.51
CB1 binding score: -17.036
InChIKey:ZESRVAFEBICQQU-UHFFFAOYSA-N
ID: 85274
SMILES:CC(O)(C1CC(O)C(C)=CC1c1c(O)ccc(CCCCC)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -12.764
InChIKey:ODPPBSOMZUONGM-UHFFFAOYSA-N
ID: 85275
SMILES:CC(=CCC(C(C)CCCC(C)=CCc1c(O)cc(C)c(O)c1)O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -15.65
InChIKey:BSSIIMLQTPBUGK-UHFFFAOYSA-N
ID: 85276
SMILES:Oc1c(C(C(CC)C)=O)c2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.453
InChIKey:NIZQVFOBIVYVBJ-UHFFFAOYSA-N
ID: 85277
SMILES:C(Cc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 85278
SMILES:C(C=C(C)C)CC(C)(O)C=Cc1c(OC)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -17.034
InChIKey:QASRARIFUBVEMD-UHFFFAOYSA-N
ID: 85279
SMILES:CC(=CCCC(C)=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 428.613
CB1 binding score: -18.353
InChIKey:QNRJPRFPLQBROG-UHFFFAOYSA-N
ID: 85280
SMILES:c1(CCCO)cc2c(c(O)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -15.851
InChIKey:RRCGNUCBROLHDW-UHFFFAOYSA-N
ID: 85281
SMILES:C1CC(CCCC)c2c(OC)cc(CCCCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.447
CB1 binding score: -12.271
InChIKey:QRQKATGLINPVCP-UHFFFAOYSA-N