ID: 92422
SMILES:C(C)(=CCCC(=C)C=C1CC(C)=CC(c2cc(CC(C)C(O)=O)ccc2OC)C1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.582
CB1 binding score: -15.05
InChIKey:ORMDFYJOVAUDMK-UHFFFAOYSA-N
ID: 92423
SMILES:C(Cc1cc(O)cc2c1OC(C)(C)C1CCC(C)=CC12)C1=C(O)C(O)C(CC=C(C)C)=C(O)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.601
CB1 binding score: -15.76
InChIKey:UTQJGZCZYMICLA-UHFFFAOYSA-N
ID: 92424
SMILES:c1c(CCCCC)cc2c(c1O)C1C(C(=C)C)CCC(C)(O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.198
InChIKey:NUXUDGMVYZUFNQ-UHFFFAOYSA-N
ID: 92425
SMILES:C12(c3c(cc(CCCCC)cc3O)OC(C=C(C)C)C1)C1=C(C(=O)CC3O1)CC(CO)(C)OC3C(C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 522.682
CB1 binding score: -15.636
InChIKey:VVQKCBFVOGRAJB-UHFFFAOYSA-N
ID: 92426
SMILES:c1c2c(cc(CCCCC)c1)OC(C)(C)C1=CCC(C)=CC1=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 308.465
CB1 binding score: -14.982
InChIKey:ZRZWIPRMIYLHLF-UHFFFAOYSA-N
ID: 92427
SMILES:CC1=CC(c2ccc(CCCCC)cc2)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.471
CB1 binding score: -19.804
InChIKey:VGBLUPCGCQUYRW-UHFFFAOYSA-N
ID: 92428
SMILES:C(CCCc1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1C(=O)C)C(=O)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -14.268
InChIKey:NNUJIHQGVLHZDG-UHFFFAOYSA-N
ID: 92429
SMILES:O(C)c1cc2c(c(CC=C(C)C)c1CC(=O)OC)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -12.382
InChIKey:YYFRTJNGDGYQHZ-UHFFFAOYSA-N
ID: 92430
SMILES:C(Cc1cc(O)c(CC=C(C)C)c(O)c1)=C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 314.469
CB1 binding score: -18.687
InChIKey:WLQHMAXRUPMVPI-UHFFFAOYSA-N
ID: 92431
SMILES:C1(C)(C)C2C(C=C(C)CC2)c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 92432
SMILES:O(C)c1c(OC)c(OC(=O)C)c(C(=O)CCC(C)C)c2c1-c1ccc(C)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.536
CB1 binding score: -15.284
InChIKey:FGAPIGBKJGMUAH-UHFFFAOYSA-N
ID: 92433
SMILES:O1c2c(c(O)c(C)c(O)c2C(C(C)CC)=O)C(OC)C(O)C1c1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 552.664
CB1 binding score: -12.672
InChIKey:RKXGYRLBHKVEOQ-UHFFFAOYSA-N
ID: 92434
SMILES:C12C(O)(C(C(=O)C)CC(C)C1O)C(C)C(OCC)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.573
CB1 binding score: -11.518
InChIKey:UADNKJBMSKWMAU-UHFFFAOYSA-N
ID: 92435
SMILES:O=CC1=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.956
InChIKey:KZZGLSUGCLMLNA-UHFFFAOYSA-N
ID: 92436
SMILES:C1C(C)(C)C2C(c3c(O)cc(CCC)cc3OC2(C)C)C2C(C)(CC1)C(Br)CC(O)C2=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 505.537
CB1 binding score: -14.684
InChIKey:WEYZOFGSNGODAH-UHFFFAOYSA-N
ID: 92437
SMILES:OCC1C(O)C(O)C(O)C(Oc2c(CCCCC)cc(O)c(CC=C(CCC=C(C)C)C)c2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 478.626
CB1 binding score: -17.641
InChIKey:OLAATYSLWREOAO-UHFFFAOYSA-N
ID: 92438
SMILES:c1c(C2C(C(C)=C)CCC(C)=C2)c(OC)c(C(C)=O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -13.658
InChIKey:LPGPHISHBVDEBR-UHFFFAOYSA-N
ID: 92439
SMILES:C1(C)=CC2C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.534
InChIKey:INKUWBOHCFHXTJ-UHFFFAOYSA-N
ID: 92440
SMILES:C(O)(C)(C)C=CC1(O)c2c(O)cc(C)cc2OC(C)(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Miscellaneous meroterpenoids
MW: 292.375
CB1 binding score: -15.929
InChIKey:GPXNMQIEXJKDCC-UHFFFAOYSA-N
ID: 92441
SMILES:C(CC(=O)O)Cc1ccc(CC=C(C)CCC=C(C)C)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.94
InChIKey:YUIBGKXWTOFGCT-UHFFFAOYSA-N
ID: 92442
SMILES:c1(O)c2c(c(C(C)(C=C)C)c(OC)c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.419
InChIKey:VRYLBAOAUQWOOB-UHFFFAOYSA-N