ID: 136585
SMILES:C(OC1C(C)=CC2c3c(c(CCCCC)cc(O)c3O)OC(C(C)(O)C)CC21)(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.53
CB1 binding score: -16.267
InChIKey:UDOSHGDGWCHDQP-UHFFFAOYSA-N
ID: 136586
SMILES:Oc1cc(CCCCC)cc2c1C1C=C(C(=O)O)CCC1C(C)(O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.998
InChIKey:OVWVWMGBDSWKKE-UHFFFAOYSA-N
ID: 136587
SMILES:C(C1CCC(C)=CC1c1c(O)cc(O)cc1C)(C)=CCCC(=CCS)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.574
CB1 binding score: -15.368
InChIKey:MRURIOWZUMRKST-UHFFFAOYSA-N
ID: 136588
SMILES:C(c1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -18.786
InChIKey:YURJBXYTSFIOOT-UHFFFAOYSA-N
ID: 136589
SMILES:C1CC2(C)CC1c1c(O)cc(CCCC)cc1O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -17.933
InChIKey:YXFGNPXVGYLXKP-UHFFFAOYSA-N
ID: 136590
SMILES:C1CC(C)=CC(c2c(O)cc(CCC)cc2O)C(C(C)(C)OO)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -12.266
InChIKey:HVMZADOFYKZWQG-UHFFFAOYSA-N
ID: 136591
SMILES:C12OC1(C)COC2c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.348
CB1 binding score: -15.116
InChIKey:NONDQVWIVYYARP-UHFFFAOYSA-N
ID: 136592
SMILES:C(OC(=O)C)CCCCc1c2ccoc2c(O)c2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.526
CB1 binding score: -12.219
InChIKey:CJMIYOCVIZWGAU-UHFFFAOYSA-N
ID: 136593
SMILES:C1CC(C)=C2C1C(O)(C)CCc1c(OC)cc(CCCCC)c(C(=O)OC(C)(C)C)c1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.612
CB1 binding score: -14.811
InChIKey:UXZVOOWSVFZOTD-UHFFFAOYSA-N
ID: 136594
SMILES:Oc1cc(C)cc2c1C1C(C(C)(C)O2)CCC(C)(O)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.375
CB1 binding score: -19.352
InChIKey:LGVIZSBMRKDNDJ-UHFFFAOYSA-N
ID: 136595
SMILES:C1(C(O)(C)C)C(c2c(O)cc(CCC)cc2O)C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -19.168
InChIKey:BMEOABJGGIYLGA-UHFFFAOYSA-N
ID: 136596
SMILES:CC1CCCC(C)=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2C(OC(=O)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.64
CB1 binding score: -14.768
InChIKey:QEVQGNHQVFQNHY-UHFFFAOYSA-N
ID: 136597
SMILES:C(=O)(c1c(O)cc(CCCCC)cc1O)OC1C=C(C)CCC1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.161
InChIKey:DRWGEHCBGXXHHO-UHFFFAOYSA-N
ID: 136598
SMILES:C12c3c(O)cc(CCCCC)cc3OC(C)(C)C1CCC(C=O)=CC2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -17.825
InChIKey:JLKJXLHEITYMJK-UHFFFAOYSA-N
ID: 136599
SMILES:C(=CCCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -18.253
InChIKey:XVXPIHYRYALXDI-UHFFFAOYSA-N
ID: 136600
SMILES:c1(O)c(C(=O)CC(C)C)c2c(c3c1OC1C=C(C)CCC1C(C)(C)O3)C=CC(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.553
CB1 binding score: -12.836
InChIKey:SYLJRCHHCOGSOL-UHFFFAOYSA-N
ID: 136601
SMILES:c1(C(=O)OC)cc(OCC(C)=O)c(C2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.434
CB1 binding score: -11.844
InChIKey:OEULZNYVHMUMFS-UHFFFAOYSA-N
ID: 136602
SMILES:C1C2(C)C(C)(C)Oc3cc(CCCCC)cc(O)c3C(O)C2C(C)(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.537
CB1 binding score: -16.218
InChIKey:KWJPHWCEPRLWIR-UHFFFAOYSA-N
ID: 136603
SMILES:O1C(C)(C)C(O)CCc2c(O)cc(CCCCC)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.392
CB1 binding score: -17.334
InChIKey:BZOYWIKHOMJWTI-UHFFFAOYSA-N
ID: 136604
SMILES:C(C1=C2C=C(C)CCC21)(C)=CCCC1(C)Oc2c(C)cc(O)cc2C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.486
CB1 binding score: -11.895
InChIKey:GVQVFESBIYIPFA-UHFFFAOYSA-N
ID: 136605
SMILES:C1(O)CCC2(C)OC1(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.402
CB1 binding score: Not available
InChIKey:OEGQMWLHVJFVDN-UHFFFAOYSA-N