ID: 92548
SMILES:C(CCCC)c1cc2c(c(O)c1)C1CC(C)(O2)C(O)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.348
CB1 binding score: -15.77
InChIKey:GTKYYVYYPXAQLJ-UHFFFAOYSA-N
ID: 92549
SMILES:c1c(CCCCC)c(OC)c2c(c1)OC(C)(C)C1=C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -15.118
InChIKey:SGOOBFTYORWZPJ-UHFFFAOYSA-N
ID: 92550
SMILES:C1CC(C(C)C)C(c2c(O)cc(CCCCC)cc2OC)CC1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.528
CB1 binding score: -18.883
InChIKey:KKBNGEMFBFEYQN-UHFFFAOYSA-N
ID: 92551
SMILES:C(CCC(C)=CCCC1(C)C=Cc2c(O)cc(CCCCCCCC)cc2O1)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.669
CB1 binding score: -16.502
InChIKey:ABICTTRWZYBMMJ-UHFFFAOYSA-N
ID: 92552
SMILES:C(c1cc2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -19.395
InChIKey:VTKCSOVWESGERA-UHFFFAOYSA-N
ID: 92553
SMILES:C(=CCCC1(C)Oc2cc(C)c(OC(C)=O)c(O)c2C=C1)C(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -14.605
InChIKey:FPUHZAOKIJRJSN-UHFFFAOYSA-N
ID: 92554
SMILES:CC1(C)C=CCC2(C)Oc3c(c(O)cc(CCCCC)c3-2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -14.617
InChIKey:WFZMOTCBKKPKTL-UHFFFAOYSA-N
ID: 92555
SMILES:C12C(C)(C)Oc3c(c(OC)cc(O)c3)C1CC(C(=C)C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -15.461
InChIKey:DCNRWYVUBFHQBV-UHFFFAOYSA-N
ID: 92556
SMILES:CCCCCc1cc2c(c(O)c1)C1CC(C)(O2)CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.198
InChIKey:NUXUDGMVYZUFNQ-UHFFFAOYSA-N
ID: 92557
SMILES:CC1(C)C2C(c3c(cc(CCCCC)c(C(O)=O)c3)O1)CC(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.07
InChIKey:QSEQGMAMGSDVIO-UHFFFAOYSA-N
ID: 92558
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1C2C=C(C(O)=O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 92559
SMILES:c1(O)c(C(O)=CC(C)C)c(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.303
InChIKey:OTDANWPIEMFZFU-UHFFFAOYSA-N
ID: 92560
SMILES:c1(O)cc(CCCC)cc2c1C1=C(C(C)(C)O2)C(C)CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -14.512
InChIKey:MCQJUZKKQGALFT-UHFFFAOYSA-N
ID: 92561
SMILES:c1(CCCCC)cc(O)c2c(c1O)OC(C)(CCC=C(C)C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -17.076
InChIKey:DGYADGILUPASIB-UHFFFAOYSA-N
ID: 92562
SMILES:O1c2c(c(O)cc(CCCC)c2)C2CC(C)=CCC2C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.175
InChIKey:RVWTXSLOGRTPEH-UHFFFAOYSA-N
ID: 92563
SMILES:C1(=O)C(=C(C)C)CC2C(C)(C)Oc3cc(CCCCC)c(C(=O)O)c(OC)c3C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.515
CB1 binding score: -11.29
InChIKey:CMQLOFZKRRIFLH-UHFFFAOYSA-N
ID: 92564
SMILES:CC1(CCC=C(C)C)C=Cc2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 92565
SMILES:CC1=Cc2c(c(O)cc(CCCCC)c2)C(C(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 286.459
CB1 binding score: -15.288
InChIKey:ABWLEKMNPABKDU-UHFFFAOYSA-N
ID: 92566
SMILES:C(c1c(CCCCC)cc2c(c1O)OC(C)(C)C1C2CC(C=O)=CC1)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -14.468
InChIKey:QOHXJRGDAVUTDM-UHFFFAOYSA-N
ID: 92567
SMILES:Oc1c(-c2c(O)c(CC=C(CCC=C(C)C)C)c(O)cc2CC=C(C)C)c(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 572.786
CB1 binding score: -16.282
InChIKey:JVIVSPWYMGNCTF-UHFFFAOYSA-N
ID: 92568
SMILES:O1c2cc(CCCCC)cc(O)c2C2CC(COC(=O)C(C)N)C(CCC(C)=O)(C1C)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 445.6
CB1 binding score: -15.424
InChIKey:IYNSYLUFOVYPMQ-UHFFFAOYSA-N