ID: 86122
SMILES:C1C(C)=CC(c2ccc(CCCCC)cc2)C(C(C)C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.487
CB1 binding score: -19.108
InChIKey:KCGRQTUOQYSEJY-UHFFFAOYSA-N
ID: 86123
SMILES:O(c1c2c(cc(C)c1)OC(C)(C)C1=C2C(C)CCC1=O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -17.182
InChIKey:UIYJYSWLCYZEJY-UHFFFAOYSA-N
ID: 86124
SMILES:CC1C2C(OC1)c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -16.515
InChIKey:SLKQQLWNDGFPMR-UHFFFAOYSA-N
ID: 86125
SMILES:c12c(c(O)c3c(c1)OC(C)(C)C1CC=C(C)C(=O)C13)CC(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.408
CB1 binding score: -14.746
InChIKey:QSELPHLDIPYCDS-UHFFFAOYSA-N
ID: 86126
SMILES:C(C)CCCc1cc2c(c(O)c1)C1C=C(CO)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 86127
SMILES:C(Cc1cc(O)c(CC=C(C)C)c(O)c1)=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 314.469
CB1 binding score: -18.687
InChIKey:WLQHMAXRUPMVPI-UHFFFAOYSA-N
ID: 86128
SMILES:OCC12Oc3c(c(O)cc(CCCCC)c3)C3C1C=CC(=O)C3C(O)(C)CC2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -14.34
InChIKey:RSFTXSFWWFGUFF-UHFFFAOYSA-N
ID: 86129
SMILES:C12C3C(C)(C4C1(C(C)(C)O4)O2)c1c(O)cc(CCCCC)cc1OC3OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -16.813
InChIKey:DLEKJDZLPZPKFH-UHFFFAOYSA-N
ID: 86130
SMILES:C(C)CCCCc1cc2c(c(O)c1)C1C(C(C)(O)C)CCC(C)(O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -16.627
InChIKey:WKVIRZJNKJVJOP-UHFFFAOYSA-N
ID: 86131
SMILES:C(CCC(C)=CCc1c(O)cc(C)cc1O)C(C)(O)C=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -16.438
InChIKey:MSBQZPMJKIIMOO-UHFFFAOYSA-N
ID: 86132
SMILES:O(c1c(CCCC)cc(O)c(CC2C(=C)CCC3C2(C)CCC(=O)C(C)(C)O3)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -15.876
InChIKey:FNMTYBGTTKHZON-UHFFFAOYSA-N
ID: 86133
SMILES:c1(CCCC)c(O)ccc2c1-c1c(ccc(C)c1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.41
CB1 binding score: -13.989
InChIKey:CDNDHSHEXJJSPQ-UHFFFAOYSA-N
ID: 86134
SMILES:C(C)CCc1cc2c(c(O)c1)C(CC(O)C(=C)C)CC1(CC(O)C3C(C)(C)C1C3)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -15.541
InChIKey:QCYBJNZCNVPBGC-UHFFFAOYSA-N
ID: 86135
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 86136
SMILES:C(C)CCCc1cc(O)c2c(c1)C1C(=O)OCC2(C)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -16.095
InChIKey:JNRIJLBNGPTAAM-UHFFFAOYSA-N
ID: 86137
SMILES:C(Cc1cc(OC)cc(O)c1)C(C1=CC2(CC(CC=C(C)C)C1)CCC=C2)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -15.334
InChIKey:HXCSELMZJRWPSN-UHFFFAOYSA-N
ID: 86138
SMILES:Oc1cc(CCCCC)cc2c1C1C(CCC(C(O)=O)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 86139
SMILES:c1(CC=C(CCC=C(C)C)C)c(O)c2c(cc1)C1C(C(C)(C)O2)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -15.22
InChIKey:QDUGOKDSPFAIDN-UHFFFAOYSA-N
ID: 86140
SMILES:C(CCCC(c1cc(O)c2c(c1)OC(C)(C)C1(O)CCC(C)=CC12)C(O)(C)C)=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -15.888
InChIKey:LITWRLLFFCXEEM-UHFFFAOYSA-N
ID: 86141
SMILES:C(CCCCc1cc(O)c(C2C(C(C)C)CCC(C)=C2)c(O)c1)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.62
CB1 binding score: -15.923
InChIKey:YLTIULBOFBQXFR-UHFFFAOYSA-N
ID: 86142
SMILES:C1(O)C(OC)C(O)C(CO)OC1OC1c2c(cc(CCCC)cc2O)OC1C(C)=C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.49
CB1 binding score: -14.228
InChIKey:BEAOPYYJGGWFFN-UHFFFAOYSA-N