ID: 116152
SMILES:C12C3(C)CCC(C)(C)C3C(O)C(O)C1(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -16.767
InChIKey:RRMDVAISTLHLTJ-UHFFFAOYSA-N
ID: 116153
SMILES:c12c(OC)cc(CCCCC)cc1OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -18.823
InChIKey:GRLARWXSTOXAGR-UHFFFAOYSA-N
ID: 116154
SMILES:O(c1c(C2C=C(C)CCC2C(C)=C)c(O)cc(OC)c1O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -16.46
InChIKey:SSFSGJCCOCJLGH-UHFFFAOYSA-N
ID: 116155
SMILES:c1c(C(=CC(=O)OC)C)c(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -14.6
InChIKey:JSLFJIYSPCUSLP-UHFFFAOYSA-N
ID: 116156
SMILES:C12C(C(C)(C)Oc3cc(CCCCC)cc(O)c31)CCC(C)(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -20.807
InChIKey:KSGRDIFQZVURIF-UHFFFAOYSA-N
ID: 116157
SMILES:C(C(C)=CCc1c(O)cc(CCCCC)cc1OC)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -19.49
InChIKey:KASVLYINZPAMNS-UHFFFAOYSA-N
ID: 116158
SMILES:C(Cc1c(OC)c2c(cc1O)OC1(C)CCC(C(C)=C)C1C2)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -16.849
InChIKey:MNOKAKHGBQKOBY-UHFFFAOYSA-N
ID: 116159
SMILES:Oc1cc(C)ccc1C(=COC(=O)C)COc1cc(CCCCC)cc(O)c1C1C(C)(C)C(O)CCC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 524.698
CB1 binding score: -16.438
InChIKey:XTGRNQPFNYHAHO-UHFFFAOYSA-N
ID: 116160
SMILES:C(C)(Oc1c(C2C(C(C)=C)CCC(C)=C2)c(O)cc(CCCCC)c1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -17.989
InChIKey:ZTZGBEZKXBIYDU-UHFFFAOYSA-N
ID: 116161
SMILES:O=CCC1=C(O)C(CC=C(CCC=C(C)C)C)=CC(O)=C1CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.929
InChIKey:JSTADPJJWHKHCM-UHFFFAOYSA-N
ID: 116162
SMILES:CC(C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.812
InChIKey:FTDORWGKHUOHKJ-UHFFFAOYSA-N
ID: 116163
SMILES:C1CC(C)(C)Oc2cc(CCCCC)c(C(=O)O)c(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.375
CB1 binding score: -19.505
InChIKey:CBTOHSIQSGOXJB-UHFFFAOYSA-N
ID: 116164
SMILES:C(CC1(C)C=Cc2c(O)cc(CCCCC)cc2O1)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -14.923
InChIKey:YAMIPMXDXNKJEE-UHFFFAOYSA-N
ID: 116165
SMILES:C(c1cc(OC)c(O)c(CC=C(CCC(C(C)=C)OC(C)=O)C)c1)C(C)=CCc1c(O)c(C)cc2c1OC1(C)CCC(C(C)=C)C1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 644.849
CB1 binding score: -14.692
InChIKey:SSXPFYMBLFKDEQ-UHFFFAOYSA-N
ID: 116166
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1=C2C(=O)C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -18.604
InChIKey:AUPXTHSHVYGTBU-UHFFFAOYSA-N
ID: 116167
SMILES:c12c(cc(CCCCC)cc1OC)OC1C(C)(O)CCC(C(=C)C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -13.261
InChIKey:IOHLCNWBSQQJDH-UHFFFAOYSA-N
ID: 116168
SMILES:C12(c3c(cc(CCCCC)cc3O)OC(C)(C)C1=O)CC(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.451
InChIKey:LCYMQLMUINSQHG-UHFFFAOYSA-N
ID: 116169
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1C2C(C(C)O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -11.702
InChIKey:HUHKFWNABRUPLD-UHFFFAOYSA-N
ID: 116170
SMILES:C(=CCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)CCCC1(CCCC(C)C)OC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.679
CB1 binding score: -14.011
InChIKey:ZUMUINFFPQIMJB-UHFFFAOYSA-N
ID: 116171
SMILES:C(CCc1cc2c(c(O)c1)C1C(C(C)(O)CCC(C(O)(C)C)O1)C(=O)O2)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.465
CB1 binding score: -16.583
InChIKey:CJMYYRGYSWLZLX-UHFFFAOYSA-N
ID: 116172
SMILES:C(CCC=C(C)C)(=CCc1c(O)cc(CCCCCO)cc1OC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -17.776
InChIKey:WPDKRAAOOWNUMO-UHFFFAOYSA-N