ID: 43051
SMILES:CC1=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 43052
SMILES:CC1=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: 43053
SMILES:CC1(CCC=C(C)C)Oc2cc(CCCCC)c(C(=O)O)c(O)c2C(=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -17.334
InChIKey:WINCRFZOLLUXNL-UHFFFAOYSA-N
ID: 43054
SMILES:CCC(O)CC(=O)c1cc2c(cc1)OC(C)(C)C1CCC(CO)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -14.638
InChIKey:BDHOOOMDJDVLGT-UHFFFAOYSA-N
ID: 43055
SMILES:c1(O)c2c(cc(CCCCCO)c1)OC(C)(C)c1ccccc12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.409
CB1 binding score: -16.061
InChIKey:PNVIOZCYTPAFOU-UHFFFAOYSA-N
ID: 43056
SMILES:C1(O)CC(C(C)(O)C)OC1(C)C1C2C(C)(CC1)Oc1c(C(OC)=O)c(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 476.61
CB1 binding score: -15.258
InChIKey:YCUFYGMYHUIKQK-UHFFFAOYSA-N
ID: 43057
SMILES:c1(CCCCCC)cc2c(c(O)c1)C1CC(C)(O2)CCC1C(O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -16.627
InChIKey:WKVIRZJNKJVJOP-UHFFFAOYSA-N
ID: 43058
SMILES:Oc1c(C(CC(C)C)=O)c(O)c2c(c1)OC(C)(C)C1CC=C(C(O)=O)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.433
CB1 binding score: -14.451
InChIKey:AQKTVPNXMZOXNK-UHFFFAOYSA-N
ID: 43059
SMILES:C12C(C)=CCC(OC(Cc3ccc(O)cc3)=O)C1C(C)(C)Oc1c2c(C)ccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.495
CB1 binding score: -14.638
InChIKey:WKLHYASOOYWLNA-UHFFFAOYSA-N
ID: 43060
SMILES:CC1(C)C2CC(C)C3CCC(C)=C3C(c3c(O)cc(CCCCC)cc3O)OC2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -14.226
InChIKey:CVQIWJCTPCHNNJ-UHFFFAOYSA-N
ID: 43061
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: 43062
SMILES:CC1(C)C2CC=C(CO)CC2c2c(O)cc(CC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -17.791
InChIKey:MGYBWSZZGZCSDI-UHFFFAOYSA-N
ID: 43063
SMILES:C1CC(C)=CC2C(C(CCC(OC(=O)C)C(CC)C)C)C1(C)Oc1cc(C)ccc12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -17.154
InChIKey:NIHRSHYDJIHOKU-UHFFFAOYSA-N
ID: 43064
SMILES:c12ccc(O)cc1OC(C)(C)C1CCC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -19.912
InChIKey:JKUWZILTAIFPQY-UHFFFAOYSA-N
ID: 43065
SMILES:C1(C)=CCCC2(C)C(O2)c2c(O)cc(CCCCC)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -15.225
InChIKey:WPAHFKAEDHXCOG-UHFFFAOYSA-N
ID: 43066
SMILES:C(C)CCCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 43067
SMILES:O(C(=O)c1c(O)c2c(cc1CCCCC)OC(C)(C)C1CC=C(C)CC21)C(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.515
CB1 binding score: -15.216
InChIKey:ALRMAIRJLBDMBL-UHFFFAOYSA-N
ID: 43068
SMILES:C12C(C)C=C(C)C1C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -14.06
InChIKey:DDVZLCBELMLNJZ-UHFFFAOYSA-N
ID: 43069
SMILES:C1(C)=CCC2C(C)(C13Cc1c(O)c(C(=O)C)c(CCCCC)cc1O2)OC(C(O)(C)C)C1OC(=O)C(C)C31
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 526.67
CB1 binding score: -15.892
InChIKey:GLYAOMVTYGYENN-UHFFFAOYSA-N
ID: 43070
SMILES:c1(O)cc(CCCCC)cc2c1-c1c(ccc(C)c1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 43071
SMILES:c1(C(=O)C(C)C)cc2c(c(O)c1)C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -16.502
InChIKey:GETVDMVIHDEMNK-UHFFFAOYSA-N