ID: 44920
SMILES:C1CC(C)=CC(c2ccc(CCCCC)cc2)C(C(=C)C)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.59
CB1 binding score: -17.849
InChIKey:NYPREZZASVIFAE-UHFFFAOYSA-N
ID: 44921
SMILES:C1CC(Cl)C(C)(C)OC12C1C(C)(CCC2)Oc2c(c(O)cc(CCCCC)c2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 421.021
CB1 binding score: -13.331
InChIKey:SBQQYAPPZFIPOM-UHFFFAOYSA-N
ID: 44922
SMILES:C1C2C(CC=C1C)C(C)(C)Oc1c2ccc(O)c1CC(C(=C)C)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -14.605
InChIKey:CCEJMSQBRKHZNA-UHFFFAOYSA-N
ID: 44923
SMILES:C(CC)CCc1c(O)c2c(c3c1OC(C1(C)C(CO)O1)C3)OC(C)(C)C1CCC(C)C(O)C21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 460.611
CB1 binding score: -15.526
InChIKey:SDGLYNPAGVSVQQ-UHFFFAOYSA-N
ID: 44924
SMILES:C(c1c(OC)c2c(cc1CCCCC)OC(C)(C)C1C2CC(C)CC1)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.593
CB1 binding score: -13.39
InChIKey:DONVPOCOICNCCR-UHFFFAOYSA-N
ID: 44925
SMILES:C(C=C(C)CCC=C(C)C)c1c(C)c(CCC)cc(O)c1OC(C)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -14.899
InChIKey:JEBVZYWBQSCSMU-UHFFFAOYSA-N
ID: 44926
SMILES:OC(C(C)C)c1cc(OC)c2c(c1)OC(C)(C)C1C2C=C(C)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: Not available
InChIKey:LMDMOWPIWBZHLK-UHFFFAOYSA-N
ID: 44927
SMILES:C(CCCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -18.354
InChIKey:OJTMRZHYTZMJKX-UHFFFAOYSA-N
ID: 44928
SMILES:O(CC1=CC2c3c(O)cc(C)cc3OC2(C)C2C(C2)C(C)CC1C=C(C)C)C(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.554
CB1 binding score: -15.255
InChIKey:QBQMYFJFGBLXDR-UHFFFAOYSA-N
ID: 44929
SMILES:C(C=C(CCC=C(C)CCC=C(C)C)C)c1cc(O)cc(CCc2ccccc2O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.621
CB1 binding score: -14.283
InChIKey:JKQNEUITXUISJW-UHFFFAOYSA-N
ID: 44930
SMILES:c1(O)c(CC=C(C)C)c(O)c(C(C(C)C)=O)c2c1C1C(C(C)(C)O2)CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -12.834
InChIKey:JLCFUONRKIMFMR-UHFFFAOYSA-N
ID: 44931
SMILES:C(CCCCCc1cc(OC)c2c(c1O)OC(C)(C)C1C2C=C(CO)CC1)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -16.535
InChIKey:UZPKYKQMYGEEEF-UHFFFAOYSA-N
ID: 44932
SMILES:C=C1CC2(O)CC3c4c(cc(O)cc4C)OC(C)(C)C3C2O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -15.328
InChIKey:JQFHVPTZEPXQBZ-UHFFFAOYSA-N
ID: 44933
SMILES:CCCc1ccc(OC)c(C2C=C(C)CCC2C(=C)C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.443
CB1 binding score: -15.166
InChIKey:ATQGMEKENLDYHH-UHFFFAOYSA-N
ID: 44934
SMILES:O=C1C(C)C2C(C)(CC3c4c(O)cc(CCCCC)cc4OC3C2)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -15.519
InChIKey:HWMXCDHRTYQOEU-UHFFFAOYSA-N
ID: 44935
SMILES:C12(C)CCC(C)C1(C(=O)OCCc1ccccc1)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.592
CB1 binding score: -13.895
InChIKey:KALVABCIIJSYEO-UHFFFAOYSA-N
ID: 44936
SMILES:Cc1cc(O)cc2c1OC(C)(C)C(O)C=CC(C)CC=CC(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -14.076
InChIKey:DKEAJGOJOOVBHV-UHFFFAOYSA-N
ID: 44937
SMILES:C12C(C)(C3(C)CCC(C)C14C(CC3C)c1c(cc(CCCCC)cc1O)O4)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -13.881
InChIKey:XCXMWFQEHPIOTF-UHFFFAOYSA-N
ID: 44938
SMILES:C(CCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CC(O)C2(C)C1(C)CCC2C)C(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -15.206
InChIKey:MKHKQQPDZQJGPN-UHFFFAOYSA-N
ID: 44939
SMILES:Oc1cc(CCCCC)cc2c1C1C(C(C)(O)C)CCC(C)(O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.841
InChIKey:UKPNRAMYBFBWKV-UHFFFAOYSA-N
ID: 44940
SMILES:C1=C(C)CCC(C(=C)CCC=C(C)C)C1c1c(O)cc(O)cc1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -17.033
InChIKey:WDUPRFVRSXAKEK-UHFFFAOYSA-N