ID: 114409
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(=C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.055
InChIKey:AOYYFUGUUIRBML-UHFFFAOYSA-N
ID: 114410
SMILES:C(c1c(-c2c(C)cc(OC)c(C(C)C)c2)c(O)c2c(c1)OC(C)(C)C1CCC(CO)CC12)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 508.743
CB1 binding score: -15.743
InChIKey:RHBZLPGTPANRMR-UHFFFAOYSA-N
ID: 114411
SMILES:Oc1c(CC=C(C)CCC=C(C)C)c(OC)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -19.49
InChIKey:KASVLYINZPAMNS-UHFFFAOYSA-N
ID: 114412
SMILES:c1(O)cc2c(cc1CCCC)OC(CCC=C(C)C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -16.699
InChIKey:IGGYOPAEODAEIA-UHFFFAOYSA-N
ID: 114413
SMILES:C1(C)(C)Oc2ccc(O)cc2C2C=C(C)CCC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -20.067
InChIKey:OBJJEVJNCDBGOD-UHFFFAOYSA-N
ID: 114414
SMILES:C12c3c(O)cc(CCCCC)cc3OC(C)C1C(=O)CC(C)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.43
InChIKey:CDBGQSJPWKEAAY-UHFFFAOYSA-N
ID: 114415
SMILES:C1C2C(C(C)(C)Oc3cc(CCCCC)cc(O)c31)CCC2(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -18.385
InChIKey:XGBLUBYIKPYOCW-UHFFFAOYSA-N
ID: 114416
SMILES:OCc1c(C(=O)OCCc2cc(O)c(O)c(OC)c2)cc(O)c(C2C=C(C)CCC2C(C)=C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.546
CB1 binding score: -17.123
InChIKey:DPBXGZOUPICETA-UHFFFAOYSA-N
ID: 114417
SMILES:CC1=CCC2C(C)(C)Oc3c(cc(O)cc3C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -17.76
InChIKey:QSENNOHYZPYNTR-UHFFFAOYSA-N
ID: 114418
SMILES:C(C)(C)C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 114419
SMILES:c12c(O)cc(CCC=CC)cc1OC(C)(C)C1CC2CCC1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.552
InChIKey:ZPEWCXOTCKKGFL-UHFFFAOYSA-N
ID: 114420
SMILES:C(C1C(O)C(O)C(O)C(Oc2c(O)cc3c(c2CCCCCC)OC(C)(C)C2CCC(C)C2C3)O1)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 508.652
CB1 binding score: -15.791
InChIKey:HVMIUEALHOHUGR-UHFFFAOYSA-N
ID: 114421
SMILES:C12C=C(C)C(O)CC1C(C)(C)Oc1cc(CCCCC)cc(OC(=O)C)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -18.025
InChIKey:LGUSYWICBLDWRV-UHFFFAOYSA-N
ID: 114422
SMILES:C12C(CCC(C)=C1)C(C)(C)Oc1cc(C)ccc12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -19.037
InChIKey:TWNNHTGNOPUEHO-UHFFFAOYSA-N
ID: 114423
SMILES:C(C)(C1CCC2(C)Oc3cc(CCCCC)cc(O)c3CC12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.583
InChIKey:BPCSQTQTIGSQEK-UHFFFAOYSA-N
ID: 114424
SMILES:CC(=O)Oc1cc(CCCCC)cc2c1C1C(CC=C1COC1C(O)C(O)C(O)C(CO)O1)C(=O)OCC2CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 602.721
CB1 binding score: -15.065
InChIKey:ABTHFEWNDJQACB-UHFFFAOYSA-N
ID: 114425
SMILES:C1(CCC(C)=O)=CC2C(C(C)(C)Oc3cc(CCCCC)cc(OC)c32)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -13.26
InChIKey:XLZQZHPLVCQJKQ-UHFFFAOYSA-N
ID: 114426
SMILES:c1(C(O)=O)cc2c(c(O)c1C)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -15.35
InChIKey:MOOHRYLIXCMELE-UHFFFAOYSA-N
ID: 114427
SMILES:c1(C2C(C(C)=C)C(c3c(O)cc(CCCCC)cc3O)C=C(C)CCC=C(C)C2)ccccc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.686
CB1 binding score: -13.737
InChIKey:GJWKWCHBVDDUOG-UHFFFAOYSA-N
ID: 114428
SMILES:C12=CC(OCC)(C)CCC1C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -14.323
InChIKey:BJHSNLXUXDXKLK-UHFFFAOYSA-N
ID: 114429
SMILES:c1(C2C=C(C)CCC2C(=C)C)c(O)c(C(=O)CC(C)C)c(O)c(Cc2c(O)c(C3C=C(C)C(=O)C=CC3(C)C)c(O)c(CC=C(C)C)c2O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 682.898
CB1 binding score: -14.11
InChIKey:CWLRQWOMOORJFS-UHFFFAOYSA-N