ID: 105169
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2CC(C(CCCO)=C(C(=O)O)C(C)C2)C1CCCCC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 472.666
CB1 binding score: -15.219
InChIKey:VIDYRMPDUAPUNP-UHFFFAOYSA-N
ID: 105170
SMILES:C(=C(C)C1c2c(O)cc(CCCCC)cc2OC(C)(C)C1CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -15.857
InChIKey:RWXWQBOFUKYAOC-UHFFFAOYSA-N
ID: 105171
SMILES:C1(c2ccc(O)cc2)Oc2cc(CCCCC)cc(O)c2C2C=C(C)CCC2C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.566
CB1 binding score: -16.239
InChIKey:PQMOOFRVAXOCEQ-UHFFFAOYSA-N
ID: 105172
SMILES:CCCc1cc(O)c(O)c2c1OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -16.609
InChIKey:PQYYMESTEWQRMQ-UHFFFAOYSA-N
ID: 105173
SMILES:C12C=C(C)CCC1C(C)(C)Oc1c2cc(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -20.067
InChIKey:OBJJEVJNCDBGOD-UHFFFAOYSA-N
ID: 105174
SMILES:C1(C)=CC(c2c(O)cc(O)cc2CCC)C=C(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -15.78
InChIKey:FIVKTZSHBBKHOY-UHFFFAOYSA-N
ID: 105175
SMILES:C12C(C)(OCC1C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -17.998
InChIKey:CCXKDADAHKJZFI-UHFFFAOYSA-N
ID: 105176
SMILES:C(CCCc1cc(OC(=O)c2ccccc2)c(CC=C(C)CCC=C(C)C)c(O)c1)CCN
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 449.635
CB1 binding score: -14.947
InChIKey:CYUYFENTBYFQTA-UHFFFAOYSA-N
ID: 105177
SMILES:C1CC(C)=CC(c2c(O)cc(CCC)cc2O)C1C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -20.128
InChIKey:YOJPFISTURZHJT-UHFFFAOYSA-N
ID: 105178
SMILES:Oc1c2c(cc(CCCCC)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: 105179
SMILES:c1(CC=C(CCC=C(C)C)C)c(O)c(C(O)=O)c(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -19.667
InChIKey:FAVCTJGKHFHFHJ-UHFFFAOYSA-N
ID: 105180
SMILES:C1C(C)(C)C2C(C)(Oc3cc(O)c(CCCCC)cc3C2)CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -13.256
InChIKey:JOMCJYYMUXZSBW-UHFFFAOYSA-N
ID: 105181
SMILES:c1(O)c(C2C=C(C)CCC2C(C)=C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 105182
SMILES:CC1C(OC(CCCCCCC)=O)CC(C(C)=C)C1c1c(OC)cc(CCCCC)cc1OC(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 500.72
CB1 binding score: -16.701
InChIKey:KFWWVMXPRHYOQI-UHFFFAOYSA-N
ID: 105183
SMILES:C(C=C(CCC=C(C)CCC=C(C(=O)O)C)C)c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -17.436
InChIKey:ZNGYHOOYNQGARQ-UHFFFAOYSA-N
ID: 105184
SMILES:C1(C)=CC(c2c(O)cc(C)cc2)C(C(=C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -19.801
InChIKey:MISWBPJELUDMFI-UHFFFAOYSA-N
ID: 105185
SMILES:C1(C(=C)C)CCC(C)=CC1c1c(O)c(-c2c(CC=C(C)C)c(CC=C(C)CCC=C(C)C)c(O)cc2)cc(O)c1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 556.787
CB1 binding score: -15.858
InChIKey:XGXTXPIUAYQEQC-UHFFFAOYSA-N
ID: 105186
SMILES:Oc1cc(CCCCC)cc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 105187
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1=C2C(O)=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.571
InChIKey:DGLLZXRYLLODKY-UHFFFAOYSA-N
ID: 105188
SMILES:C12C=C(C(C)(C)OO)CCC1(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.185
InChIKey:BKSKLUPQAWTDMF-UHFFFAOYSA-N
ID: 105189
SMILES:C(c1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1)c1cc(C)ccc1C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.567
CB1 binding score: -15.518
InChIKey:RNWZKDQJSATFLI-UHFFFAOYSA-N