ID: 49414
SMILES:O1c2c(c(O)cc(COC)c2)C2C=C(C)CCC2C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -15.493
InChIKey:HQCCDQGGBHBFIN-UHFFFAOYSA-N
ID: 49415
SMILES:C(=O)(C)OC1c2c(cc(CCCCC)cc2O)OC(C)(C)C2CCC(C)(O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -16.235
InChIKey:ZXRLKSOYXAGXHM-UHFFFAOYSA-N
ID: 49416
SMILES:C(CC)CCc1cc2c(c(O)c1)C1(O)C(=O)C(C)(C)OC(C1)C2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -14.605
InChIKey:ICNBQFUQINYZOH-UHFFFAOYSA-N
ID: 49417
SMILES:c1(CCCCC)cc2c(c(O)c1C=O)OC(C)(C)C1C2CC2(C1)OCC2=CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -13.205
InChIKey:IKAFVQPFPFWGGA-UHFFFAOYSA-N
ID: 49418
SMILES:C(CCC)c1cc(O)c(C2C(C(=C)C)CC=C(CCC=C(C)C)C2)c(O)c1Cc1ccccc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.686
CB1 binding score: -13.402
InChIKey:FXINRUWWLODKLQ-UHFFFAOYSA-N
ID: 49419
SMILES:Oc1cc(CCCCC)cc2c1C1C(CC(C(=C)C)C2(CCC(=O)O)C)o1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -14.708
InChIKey:HZLREXIQJPVPBN-UHFFFAOYSA-N
ID: 49420
SMILES:Oc1c2c(cc(O)c1C(C(C)CCCCC)=O)OC(C)(C)C1CCC(CO)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -16.401
InChIKey:GGIBFPKPWDFQDR-UHFFFAOYSA-N
ID: 49421
SMILES:C1(C(=C)C)C(c2c(O)cc(CCCCC)cc2O)C=C(C(=O)OC)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.286
InChIKey:CFAWMAWNLAOICA-UHFFFAOYSA-N
ID: 49422
SMILES:C(CCC)CCc1cc2c(c(O)c1)C1CC(C)(O2)CCC1C(O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -16.627
InChIKey:WKVIRZJNKJVJOP-UHFFFAOYSA-N
ID: 49423
SMILES:C1(=COC2OC(=O)C(C)=C2)C(O)C2c3c(O)cc(CCCCC)cc3OC(C1)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.471
CB1 binding score: -15.703
InChIKey:BCRCAXOWXIJASL-UHFFFAOYSA-N
ID: 49424
SMILES:C12(c3c(cc(CCCCC)cc3O)OC1(C)C)OC1(C)CCC(C(=CCC=C(C)C)C)C1CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.706
CB1 binding score: -16.357
InChIKey:QJCJBMFUPDSNRI-UHFFFAOYSA-N
ID: 49425
SMILES:OC1(C)C2(COc3cc(CCCCC)cc4c3C=CC(C)(C)O4)OC(C(O)(C)CC2)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.585
CB1 binding score: -13.522
InChIKey:TUPIUSRXOAIHFZ-UHFFFAOYSA-N
ID: 49426
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C(O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -19.729
InChIKey:GIIVGKMZIUKMMN-UHFFFAOYSA-N
ID: 49427
SMILES:Oc1c2c(cc(C)c1)OC(C)(C)c1C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -18.804
InChIKey:NJEVKSYKELTXNY-UHFFFAOYSA-N
ID: 49428
SMILES:c1c(C=Cc2c(O)c(CC=C(CCC=C(C)C)C)cc(O)c2)cc2c(c1)OC(C)(C)C1C2C=C(C(O)=O)CC1
Pathway: Shikimates and Phenylpropanoids;Terpenoids
Superclass: Meroterpenoids;Stilbenoids
Class: Cannabinoids;Monomeric stilbenes
MW: 528.689
CB1 binding score: -13.455
InChIKey:JUILMEIHMKPINC-UHFFFAOYSA-N
ID: 49429
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C=C(C(=O)O)CCC2C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 49430
SMILES:c1c(C)cc2c(c1CCC)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.443
CB1 binding score: -14.242
InChIKey:SYZCKTMUTIPOMK-UHFFFAOYSA-N
ID: 49431
SMILES:C1C(C)=CC(c2ccc(CCCCC)cc2)C(C(C)C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.487
CB1 binding score: -19.108
InChIKey:KCGRQTUOQYSEJY-UHFFFAOYSA-N
ID: 49432
SMILES:c1c(O)c2c(c(C(C)(C=C)C)c1O)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -15.019
InChIKey:NHEDSSQTBDJTMM-UHFFFAOYSA-N
ID: 49433
SMILES:C1C(C)(C)Oc2c(O)cc(CCCCC)cc21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 234.339
CB1 binding score: -17.361
InChIKey:JHLZGNOLXXKESE-UHFFFAOYSA-N
ID: 49434
SMILES:C1CC(C(C)=C)C(c2ccc(C)cc2O)C=C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -19.801
InChIKey:MISWBPJELUDMFI-UHFFFAOYSA-N