ID: 35995
SMILES:COc1ccc(CCc2cc(O)c(CC=C(C)CCC=C(C)CCC=C(C)C)c(O)c2)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.647
CB1 binding score: -17.255
InChIKey:YPINPZLDNYDUJE-UHFFFAOYSA-N
ID: 35996
SMILES:C1C(C)=CC2C(C(C)(C)Oc3c2c(O)cc(CCC)c3)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.321
InChIKey:ZROLHBHDLIHEMS-UHFFFAOYSA-N
ID: 35997
SMILES:C(Cc1cc(O)c(C2OC(CO)C(O)C(O)C2O)c(=O)c2c1OC(C)(C)C1CCC(C)=CC21)CCCCC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 532.674
CB1 binding score: -13.6
InChIKey:SGWRICXYLHMCGT-UHFFFAOYSA-N
ID: 35998
SMILES:O1c2c(c(O)cc(CCCCC)c2)C(=O)C2(C)C1(C)CCC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -13.61
InChIKey:LZMXTFCWWBSKAA-UHFFFAOYSA-N
ID: 35999
SMILES:c1(CCCCCC)cc(O)c2c(c1)OC(C)(C)C1CC=C(C)C(O)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.587
InChIKey:GUXRZTAWERUKSO-UHFFFAOYSA-N
ID: 36000
SMILES:C1(C(C)=C)C(c2cc(CCN(C)C)ccc2O)C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 299.458
CB1 binding score: -17.957
InChIKey:JVTBDUWWCYUSCG-UHFFFAOYSA-N
ID: 36001
SMILES:CC1(C)Oc2cc(C)c(O)cc2C2CC(OC(C)=O)C(C(OC)=O)=CCC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.433
CB1 binding score: -15.894
InChIKey:YJXMOEJKYBGWTA-UHFFFAOYSA-N
ID: 36002
SMILES:C1C2c3c(cc(CCCCC)cc3O1)OC(C)(C)C2CCC(C)=CCCC(C)CC(O)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.64
CB1 binding score: -14.172
InChIKey:URDIMYIBSQVKKX-UHFFFAOYSA-N
ID: 36003
SMILES:c1(O)cc2c(cc1O)OC(C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -18.748
InChIKey:UESOFUAUNDLWRH-UHFFFAOYSA-N
ID: 36004
SMILES:c1(O)cc(CCCC)cc2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 36005
SMILES:C1(O)(C)CCC(C(=C)C)C(Oc2c(O)ccc(CCCCCC)c2)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -15.663
InChIKey:UHFAENDUNRBSFB-UHFFFAOYSA-N
ID: 36006
SMILES:Oc1c2c(cc(CCCCC)c1)OC(CCC=C(C)CCC=C(C)C)(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -19.601
InChIKey:JXEWSPILIYHMCP-UHFFFAOYSA-N
ID: 36007
SMILES:CC(C)=CC1CCC2(C)Oc3ccc(CCCCC)cc3C2C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.497
CB1 binding score: -14.445
InChIKey:WLDUJABVAWZIJY-UHFFFAOYSA-N
ID: 36008
SMILES:c12c(OP(O)(=O)OCC)cc(CCCCC)cc1OC(C)(C)C1(O)CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.501
CB1 binding score: -16.759
InChIKey:MDNKEGKUJZFGRQ-UHFFFAOYSA-N
ID: 36009
SMILES:C12C(c3c(cc(CCCC)cc3O)OC1(C)C)C(O)CCC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -15.929
InChIKey:FJNMTLYYVXRQLX-UHFFFAOYSA-N
ID: 36010
SMILES:C(O)(=O)c1c(C(COC(=O)C(CC)C)=CC)cc(OC)c(C2C=C(C)CCC2C(=C)C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.579
CB1 binding score: -14.745
InChIKey:YDXFQZYPFUJGNL-UHFFFAOYSA-N
ID: 36011
SMILES:C=C1C=C(C)CCC2C(C(O)(C)C)(C2)c2c(O)cc(CCCCC)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -13.618
InChIKey:CQOVMMUYTXMDOF-UHFFFAOYSA-N
ID: 36012
SMILES:C12(c3c(cc(CCCCC)cc3O)OC1CC=C(C)CCC=C(C)C)C(OC)OCC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -18.66
InChIKey:CGILXXHYQVKTKH-UHFFFAOYSA-N
ID: 36013
SMILES:C1C(COC(C#CC#CC#CC#CCOC(C)=O)=O)c2c(cc(CCCCC)cc2O)OC1(C1CC=C(C)CC1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 554.683
CB1 binding score: -16.238
InChIKey:OCMLIYMDHBVYEY-UHFFFAOYSA-N
ID: 36014
SMILES:C=C(C)CC(O)Cc1cc2c(c(O)c1)C1CC(=C)C(O)CC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -14.903
InChIKey:GSXLQBPYPFDVHQ-UHFFFAOYSA-N
ID: 36015
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1C2CC(C)(O)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -17.774
InChIKey:GKYGKYSJIDSYCQ-UHFFFAOYSA-N