ID: 77050
SMILES:C1=C(C)CCC2C(C1)c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -18.15
InChIKey:FXRYFSBEEDYORZ-UHFFFAOYSA-N
ID: 77051
SMILES:C1=C(C)CC2C(C1)C(C)(C)Oc1cc(C)ccc12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -17.589
InChIKey:ILPMEUDSBVWXIW-UHFFFAOYSA-N
ID: 77052
SMILES:C1=C(C)CCC(C(C)C)C1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 77053
SMILES:CC1(C)C(Cc2c(O)cc(CCC)cc2O)=C(C)CCC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -16.741
InChIKey:NMTVABVSTZSKKR-UHFFFAOYSA-N
ID: 77054
SMILES:C(c1cc(O)c2c(c1)OC(CCC=C(C)CCC=C(C)C)(C)C2=O)CO
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.59
InChIKey:UMNORKBWVSKXGO-UHFFFAOYSA-N
ID: 77055
SMILES:c1(CCCCC)cc(O)c(C2C(C(C)=C)CC=C(C)C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.129
InChIKey:ZTGXAWYVTLUPDT-UHFFFAOYSA-N
ID: 77056
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.487
CB1 binding score: -19.108
InChIKey:KCGRQTUOQYSEJY-UHFFFAOYSA-N
ID: 77057
SMILES:Oc1c2c(cc(C(C(C)CCCCCCCCCC)=O)c1)OC(C)(C)C1CC(O)C(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.667
CB1 binding score: -14.369
InChIKey:ORSHLCRXWJWMAU-UHFFFAOYSA-N
ID: 77058
SMILES:O(C(c1c(O)c(CC=C(CCC=C(C)C)C)c(O)cc1CCCCC)=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 374.521
CB1 binding score: -19.567
InChIKey:RSOBBJCWWQRAAM-UHFFFAOYSA-N
ID: 77059
SMILES:c1c(CCCCC)c2c(c(C(C(C)C)=O)c1O)OC1C3C(CCC3(O)C)C(C)(C)OC2=CC(C)(OCC)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 528.73
CB1 binding score: -17.039
InChIKey:UTLOCBUFCRRAEF-UHFFFAOYSA-N
ID: 77060
SMILES:CC1(O)CCC2C1Cc1c(cccc1C)OC2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -17.411
InChIKey:CLRJZVKZZJIVBP-UHFFFAOYSA-N
ID: 77061
SMILES:CC12CC(c3c(O)cc(CCCCC)cc3O1)C(C(C)=C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.198
InChIKey:NUXUDGMVYZUFNQ-UHFFFAOYSA-N
ID: 77062
SMILES:CCc1c(O)c2c(c(O)c1)C1CC(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -15.723
InChIKey:YUNOKKRVUGTRAT-UHFFFAOYSA-N
ID: 77063
SMILES:c1(OC)cc(CCCCC)cc2c1C1C=C(C(=O)OC)C(O)C(OC(=O)C)C1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.54
CB1 binding score: -15.542
InChIKey:UIIGCHOFSAPQBK-UHFFFAOYSA-N
ID: 77064
SMILES:OC1C(C)=CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -14.395
InChIKey:MZCBLQPXGSCVGW-UHFFFAOYSA-N
ID: 77065
SMILES:Brc1c(CC=CC)cc(OC)c2c1OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 391.349
CB1 binding score: -17.222
InChIKey:LQWWFJQOPFGTRS-UHFFFAOYSA-N
ID: 77066
SMILES:O(C(c1ccccc1C)=O)C1C(C(C)(C)O)CCC2(C)Oc3cc(CCCC)cc(O)c3C=C(C)C=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 518.694
CB1 binding score: -11.211
InChIKey:YQLVXRXKWYOZKZ-UHFFFAOYSA-N
ID: 77067
SMILES:CC1C2C3(CCC1(C)O)C(C(C)(C)Oc1cc(CCCCCO)cc(O)c13)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -14.984
InChIKey:SYAHRPCSJKAXDE-UHFFFAOYSA-N
ID: 77068
SMILES:C1C=C(C)Cc2c(O)cc(CCCCC)cc2C1C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 286.459
CB1 binding score: -16.516
InChIKey:AKUZSWIOTOYEMQ-UHFFFAOYSA-N
ID: 77069
SMILES:C(CCCC)c1cc(C2C=C(C)CCC2=O)cc(O)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -15.984
InChIKey:CZBHQKXVOQNUDJ-UHFFFAOYSA-N
ID: 77070
SMILES:C(=C(CCC=C(C)C)C)Cc1c(O)c2c(cc1O)OC1(C)C=CC(C(C)C)CC1C2O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -15.467
InChIKey:XOVTZLJSWHGFPZ-UHFFFAOYSA-N