ID: 57226
SMILES:C(CCCCCCCCCC)C(=O)Oc1cc2c(cc1OC(C)=O)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 484.677
CB1 binding score: -16.419
InChIKey:QWRDSJOGIIRBQT-UHFFFAOYSA-N
ID: 57227
SMILES:c1(O)cc2c(cc1C)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -19.091
InChIKey:DENJPBAXNZGHTK-UHFFFAOYSA-N
ID: 57228
SMILES:c1(C)c2c(cc(C)c1C)OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 270.416
CB1 binding score: -15.068
InChIKey:PCHNAPZAWUVHIZ-UHFFFAOYSA-N
ID: 57229
SMILES:C1(Br)CC(C2CCC(Cl)(C)C(Br)C2)(C)Oc2c(c(O)cc(CCCCC)c2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 536.776
CB1 binding score: -12.017
InChIKey:NPEVYGVVEOUSIU-UHFFFAOYSA-N
ID: 57230
SMILES:c1(O)c2c(cc(C3C(=O)C(O)C4C(C)(C)C3C4)c1O)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.526
CB1 binding score: -13.245
InChIKey:LSYGVGCIZPAWLX-UHFFFAOYSA-N
ID: 57231
SMILES:Cc1ccc2c(c1)OC1(C)C(C)(CC2)C(C)(C)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -17.575
InChIKey:ZTFRVPOMKUOKHQ-UHFFFAOYSA-N
ID: 57232
SMILES:C1=C(C)COc2c3c(cc(CCCCC)c1)OC(C)(C)C1CCC(C)(C21O)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -14.605
InChIKey:NIKSUTZXFZAILK-UHFFFAOYSA-N
ID: 57233
SMILES:C(Cc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)C1)=N
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 287.403
CB1 binding score: -12.596
InChIKey:IXMANFAJFVQRSR-UHFFFAOYSA-N
ID: 57234
SMILES:COC1C=C(C)CC2C1C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.235
InChIKey:DUZASKIWBDUYPH-UHFFFAOYSA-N
ID: 57235
SMILES:C(CCCc1cc(O)c(CC=C(CCC=C(C)C)C)c(O)c1)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.566
CB1 binding score: -16.264
InChIKey:MJOKGZSLSNZAJG-UHFFFAOYSA-N
ID: 57236
SMILES:O(Cc1c(O)c(CCC)cc2c1C1C(CCC(CO)=C1)C(C)(C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -17.374
InChIKey:DYKMDRCNERFZJN-UHFFFAOYSA-N
ID: 57237
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1=C2C(=O)C2=CCCC(C)C2(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.555
CB1 binding score: -15.526
InChIKey:SYWDKSQBWSGEKC-UHFFFAOYSA-N
ID: 57238
SMILES:C1C(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 57239
SMILES:C(C(C)C1CC=C(C)CC1)c1c(O)c(C(=O)O)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -15.423
InChIKey:DAWCUWUHNSIFJX-UHFFFAOYSA-N
ID: 57240
SMILES:C(CCc1cc(O)c(CC=C(C)CCC=C(C)C)c(O)c1)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 342.523
CB1 binding score: -18.105
InChIKey:APNLZBJARSTBFQ-UHFFFAOYSA-N
ID: 57241
SMILES:C(CCc1cc(OC)c(C2C(C(C)=C)CC(O)C(C)=C2)cc1)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -16.476
InChIKey:DMIGGMXZWLQQSJ-UHFFFAOYSA-N
ID: 57242
SMILES:C1(=O)OC2c3c(O)cc(CCCCC)cc3OC(C)(CCC=C(C)C1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -16.013
InChIKey:DBMCPOMCNLSDHN-UHFFFAOYSA-N
ID: 57243
SMILES:O(C)c1cc(CCCCCC)cc2c1-c1c(ccc(C)c1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.491
CB1 binding score: -16.751
InChIKey:QCDUKVGBYIBTSJ-UHFFFAOYSA-N
ID: 57244
SMILES:C1C(C(C)=C)C(c2c(O)cc(CCCC)cc2O)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.739
InChIKey:WBRXESQKGXYDOL-UHFFFAOYSA-N
ID: 57245
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 57246
SMILES:C1(C)c2c(cc(C)cc2)-c2c(O)cc(CCCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.383
CB1 binding score: -16.453
InChIKey:UHUBCBLSLFZCDT-UHFFFAOYSA-N