ID: 101326
SMILES:C1C(C(C)=C)C(c2cc(CCCCC)cc(O)c2)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -19.107
InChIKey:AKCTZOKCVCWTGX-UHFFFAOYSA-N
ID: 101327
SMILES:O1C2(CCCC)C(CC(C)C3=C1C(O)C(C=C(C(O)=O)C)C(C)(CC(=O)c1cc(O)ccc1O)C3=O)C(C(=C)C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 580.718
CB1 binding score: -15.499
InChIKey:DJGLLHYEFAFPAG-UHFFFAOYSA-N
ID: 101328
SMILES:C(CCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1)CN
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 329.484
CB1 binding score: -16.521
InChIKey:ADGFEWWRNIVJDE-UHFFFAOYSA-N
ID: 101329
SMILES:COc1cc(C)cc(C2C(C(C)(C)OO)CCC(CO)=C2)c1CCCCC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.537
CB1 binding score: -14.187
InChIKey:YJBJPMXPLRDXEW-UHFFFAOYSA-N
ID: 101330
SMILES:C1C(C(CO)=C)CCc2c(O)cc(CCCCC)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -14.289
InChIKey:LROVKWDXOJJEMW-UHFFFAOYSA-N
ID: 101331
SMILES:C(CCC)CCc1cc2c(c(O)c1)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -20.649
InChIKey:ZHYPKENABBMAAN-UHFFFAOYSA-N
ID: 101332
SMILES:C1CC(C)=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 101333
SMILES:O(C)CCc1cc(O)c(CC=C(CCC=C(C)C)C)c(OC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -17.32
InChIKey:WVNSAPUNOVHUHE-UHFFFAOYSA-N
ID: 101334
SMILES:C1C(C)=CC(c2c(O)cc(CCC)cc2O)C(C(=C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N
ID: 101335
SMILES:C1C(c2cc(C(=O)O)c(CCCCC)cc2O)C(C(C)=C)CCC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.66
InChIKey:LTTFNUILQOSILJ-UHFFFAOYSA-N
ID: 101336
SMILES:c1(O)cc(CCCCC)cc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 101337
SMILES:c12c(O)cc(C)cc1OC1(C)C(C(C)C(O)C21)CCC(CO)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: -17.334
InChIKey:WWXVVNALUCWGIK-UHFFFAOYSA-N
ID: 101338
SMILES:C(C)(C1C(OSc2c(CCCCC)cccc2)=CC(C)=CC1)=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.493
CB1 binding score: -15.415
InChIKey:SKUMDFVWAFZNCY-UHFFFAOYSA-N
ID: 101339
SMILES:C1CC(O)C2(c3c(O)cc(CCCCC)cc3OC2(C)C)C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -13.522
InChIKey:QIIUZUZUMIWDAP-UHFFFAOYSA-N
ID: 101340
SMILES:C1=C(C)CCC2C(C)(C)Oc3cc(CCCCCCCCC)c(C(=O)OC)c3c2C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -15.025
InChIKey:MVAANBVYXZHNGL-UHFFFAOYSA-N
ID: 101341
SMILES:C1=CC(C(C(C)C)c2cc(CCCCC)cc(O)c2C=O)OC1(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -13.522
InChIKey:GSORATUUBAURTR-UHFFFAOYSA-N
ID: 101342
SMILES:C1(O)C(C)=CC(c2c(O)cc(CCCCC)cc2O)C(C(C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.238
InChIKey:BJYXQJGARPKCEI-UHFFFAOYSA-N
ID: 101343
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: 101344
SMILES:C1CC(CCCC(CCCC(C)C)C)(C)OC(c2c(O)cc(CCCCC)cc2O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.689
CB1 binding score: -12.209
InChIKey:PEKBSGCFOKYKJL-UHFFFAOYSA-N
ID: 101345
SMILES:C(=O)(C(O)(CC(=O)OC)c1c(CC=C(C)C)c(O)cc(CCC)c1)C(=C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -12.922
InChIKey:SMGKJPBCVRBJLU-UHFFFAOYSA-N
ID: 101346
SMILES:c12c(CC=C(C)C)c(OC)cc(C(=O)O)c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -14.605
InChIKey:HIURBEYMPZYKAP-UHFFFAOYSA-N