ID: 117160
SMILES:C1(=O)C2(OC(C)(C)C1)c1c(O)cc(O)cc1OC(C)(CCC=C(C)C)C1C2C=C(C)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.58
CB1 binding score: -12.769
InChIKey:BHSKUPATQUTSTR-UHFFFAOYSA-N
ID: 117161
SMILES:c1(CC(C(=O)NCCS(=O)(O)=O)C)cc(O)c(C2C=C(C)CCC2C(C)=C)c(N)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.574
CB1 binding score: -16.323
InChIKey:ODRXLHURHLTMNJ-UHFFFAOYSA-N
ID: 117162
SMILES:Oc1c2c(cc(CCC)c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.321
InChIKey:ZROLHBHDLIHEMS-UHFFFAOYSA-N
ID: 117163
SMILES:Cc1cc2c(c(O)c1)-c1c(cc(CCCCC)cc1O)OC(C)(C)CC2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.473
CB1 binding score: -15.663
InChIKey:XEIXRBLANZMZMW-UHFFFAOYSA-N
ID: 117164
SMILES:C1C2C(C1(C)C)Oc1cc(CCCCCC)cc(O)c1C2=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -15.159
InChIKey:FBDIKUJIFZSMMQ-UHFFFAOYSA-N
ID: 117165
SMILES:C1=C(C)C2CC2(C(C)C)C1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.609
InChIKey:JQSHIVGECYPXPI-UHFFFAOYSA-N
ID: 117166
SMILES:C(C)Oc1cc(C)cc(O)c1C1C(C(C)=CC=CC(C)(C)O)CC(OC(=O)C)C(COC(=O)C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 486.605
CB1 binding score: -15.892
InChIKey:CFORRPBUTGZOPO-UHFFFAOYSA-N
ID: 117167
SMILES:C12C(O)(C)CCC(CC=C(C)CC1c1c(O)cc(CCCCC)cc1OC)C2C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.657
CB1 binding score: -15.429
InChIKey:NNVXOJZPDIPIOX-UHFFFAOYSA-N
ID: 117168
SMILES:OC(=NC(C)(C)C=C)Oc1cc(CCCCC)cc2c1OC(C)(C)C1CCC(C)(O)C=C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 441.612
CB1 binding score: -15.174
InChIKey:JHZRQYWSVKUNGH-UHFFFAOYSA-N
ID: 117169
SMILES:C12C(C)(C)Oc3cc(CCCCC)c(C(O)=O)c(O)c3C(C1)C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -15.045
InChIKey:IMJYHBZUWHPCCY-UHFFFAOYSA-N
ID: 117170
SMILES:c1c(C2C=C(C)CCC2C(C)=C)c(O)ccc1OC(=O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -17.142
InChIKey:BOKSXUVCNMISJY-UHFFFAOYSA-N
ID: 117171
SMILES:C(CCCC)c1cc(OC)c2c(c1)OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -18.823
InChIKey:GRLARWXSTOXAGR-UHFFFAOYSA-N
ID: 117172
SMILES:c1(O)c(CC=C(C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -20.5
InChIKey:YVUPWYODRDEDFU-UHFFFAOYSA-N
ID: 117173
SMILES:c1(C2C(C(O)(C)C)CCC(C)=C2)c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.812
InChIKey:FTDORWGKHUOHKJ-UHFFFAOYSA-N
ID: 117174
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C(O)(C(C)(C)CCC1O)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: -14.828
InChIKey:VUXWORYQFNWTTD-UHFFFAOYSA-N
ID: 117175
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCCO)c2)C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.915
InChIKey:LNEDOGQBWSHVNR-UHFFFAOYSA-N
ID: 117176
SMILES:C1(CCC=CC)=C(C)CC(c2c(O)cc(CCCCC)cc2O)(CC=C(C)CCC2C(C)(C)CCC=C2C(O)=O)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 576.818
CB1 binding score: -13.781
InChIKey:JMWITJVUEBBLTE-UHFFFAOYSA-N
ID: 117177
SMILES:C(C12C(CCC3(C)Oc4c(cc(OC)c(O)c4)CC3C1(C)C)O2)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -13.39
InChIKey:UZBAFMILEOFCLL-UHFFFAOYSA-N
ID: 117178
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1C(O)COC(=O)C1=CC2=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.433
CB1 binding score: -14.029
InChIKey:BKKCAUDZHSVTLE-UHFFFAOYSA-N
ID: 117179
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C(CC=C(C)CCC=C(CC=CC(O)(C)C)C)C2=O)c1ccc(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 532.721
CB1 binding score: -13.486
InChIKey:WYXOYGLFXOTNOF-UHFFFAOYSA-N
ID: 117180
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N