ID: 59746
SMILES:C1(=O)C(C)Oc2c(c(O)cc(CCCCC)c2)C1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.321
CB1 binding score: -16.78
InChIKey:MYNJTFOPSXHAKM-UHFFFAOYSA-N
ID: 59747
SMILES:C(CCCC)=Cc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -15.5
InChIKey:PCJVPMCGPBQCJN-UHFFFAOYSA-N
ID: 59748
SMILES:C(C)(C)=CCC1=CC(CCC(=O)C)c2c(cc(C)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -16.253
InChIKey:RSTXAUJVZOXRLK-UHFFFAOYSA-N
ID: 59749
SMILES:C1(C)=C(O)CC2C(C)(C)Oc3cc(CCCCC)cc(OC(=O)C)c3C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -16.736
InChIKey:LCHNHWZALWSLDH-UHFFFAOYSA-N
ID: 59750
SMILES:CC(C)C12CCC(=C)C=C1c1c(cc(CCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.426
CB1 binding score: -17.139
InChIKey:RTXWKYJPKRRNBX-UHFFFAOYSA-N
ID: 59751
SMILES:C(CC)Cc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C(O)=O)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -16.975
InChIKey:DHXIVHTVASKKFZ-UHFFFAOYSA-N
ID: 59752
SMILES:c1(O)c2c(cc(CCCCCCC)c1)OC(C)(C)c1c-2cc(C)c(Br)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 417.387
CB1 binding score: -14.014
InChIKey:OISJVGCPYHZDFV-UHFFFAOYSA-N
ID: 59753
SMILES:Cc1c(O)c(C(C)C(CC)=O)c(O)c2c1OC1(C)CCC(C(C)=C)C2C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -16.018
InChIKey:LMALKPYHIHQSBY-UHFFFAOYSA-N
ID: 59754
SMILES:c1(O)cc(C)c(CCC2(C)CCCC(C)(C)O2)c(C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.42
CB1 binding score: -14.734
InChIKey:HBNQYGGMOKCBPQ-UHFFFAOYSA-N
ID: 59755
SMILES:C(C1CCC(C)=CC1c1c(O)cc(CCC)cc1O)(O)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -19.168
InChIKey:BMEOABJGGIYLGA-UHFFFAOYSA-N
ID: 59756
SMILES:C1C(C)C2(C=C(C)CC2)c2c(cc(CCCCC)c(C(=O)O)c2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.736
InChIKey:PKZRZXBMWBEDQX-UHFFFAOYSA-N
ID: 59757
SMILES:C1(C)=CC2C(CC1)C(C)(C)Oc1c2c(O)cc(O)c1C=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.343
CB1 binding score: -17.321
InChIKey:CMBFQSLUVVLKBC-UHFFFAOYSA-N
ID: 59758
SMILES:c1c(O)c(C2CC(C)=CC(c3c(OC)ccc(CCN(C)C)c3)C2C(C)=C)ccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 405.582
CB1 binding score: -15.415
InChIKey:FNMQDSGSJAVZCV-UHFFFAOYSA-N
ID: 59759
SMILES:C(C)=C(C)C(=O)OC1C2OC23C(=CC1=O)C1(C)C(c2c(cc(CCCCC)cc2O)O1)CC3O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.546
CB1 binding score: -15.151
InChIKey:DRINIMIGZQQOQP-UHFFFAOYSA-N
ID: 59760
SMILES:C(Cc1c(O)c2c(c(CC=C(C)C)c1O)OC(C)(C)C1CCC(C)=CC21)NCCCO
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 429.601
CB1 binding score: -14.457
InChIKey:JJHLRWLZBMOHKK-UHFFFAOYSA-N
ID: 59761
SMILES:c1(O)c(C2CC(C(C)=C)CC=C2C)c(O)c2c(c1)OC(CCC=C(C)C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.555
CB1 binding score: -17.229
InChIKey:AIZLVXJZZRKRSU-UHFFFAOYSA-N
ID: 59762
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C(C(=C)C)CCC(C)(O)C1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.142
InChIKey:RBEAVAMWZAJWOI-UHFFFAOYSA-N
ID: 59763
SMILES:C(CCCCCC)C=CC=CC(=O)OCC1(O)CC2C(CC1C)c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 540.785
CB1 binding score: -13.649
InChIKey:GWVVISPRSCABIQ-UHFFFAOYSA-N
ID: 59764
SMILES:Oc1c(CC=C(C)C)c(OC)c(C(=O)c2ccccc2)c2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Phloroglucinols
Class: Cannabinoids;Prenylated,geranylated phloroglucinols
MW: 446.587
CB1 binding score: -15.81
InChIKey:VEXOKAAYIFSZKU-UHFFFAOYSA-N
ID: 59765
SMILES:C(c1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1)NCc1ccccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 363.501
CB1 binding score: -17.03
InChIKey:CPHABDQFVOZMEC-UHFFFAOYSA-N
ID: 59766
SMILES:C(CCC(C)C)c1ccc2c(c1)OC(C)(C)C=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.378
CB1 binding score: -16.164
InChIKey:UIULLDSATNWGPQ-UHFFFAOYSA-N