ID: 63001
SMILES:C1(C)(C)C(CCC2(C)C=Cc3c(cc(C)cc3O)O2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -19.337
InChIKey:CPBHEJIKHIHMDY-UHFFFAOYSA-N
ID: 63002
SMILES:CC1(C)C2C(C=C(C)CC2)c2c(cc(C)cc2)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -19.037
InChIKey:TWNNHTGNOPUEHO-UHFFFAOYSA-N
ID: 63003
SMILES:C12(C)CC=C(C)C(C)C1c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -15.918
InChIKey:RBVMQPBAEAJQJO-UHFFFAOYSA-N
ID: 63004
SMILES:C1CC2(C)Oc3c(c(OC)cc(CCCCC)c3)C3OC(C=C(C)C)CC(C)C23C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -15.654
InChIKey:ZMACUBJPDMGRBJ-UHFFFAOYSA-N
ID: 63005
SMILES:Oc1c(CC=C(C)C)c(OC)cc(CCCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.393
CB1 binding score: -19.169
InChIKey:FCNLMUQPSJEBQE-UHFFFAOYSA-N
ID: 63006
SMILES:O1c2c(c(O)cc(CCCCCC)c2)C2(C)CCCC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -15.085
InChIKey:WMOQFRFZAPHFPX-UHFFFAOYSA-N
ID: 63007
SMILES:C(CCc1cc2c(c(OC)c1)C1C(C(C)(O)C)CCC1(C)O2)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.876
InChIKey:ZRTCHWRVSYMIAB-UHFFFAOYSA-N
ID: 63008
SMILES:C1(C)=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: 63009
SMILES:c1(C(C(C)CC)C)c(O)c2c3c(c1O)OC(C)(C)C(CCC(C)=CC2)O3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -14.744
InChIKey:JCQDAKQQNWOLEH-UHFFFAOYSA-N
ID: 63010
SMILES:Oc1c2c(cc(CCCCC)c1)OC(CCC=C(CCC=C(CO)C)C)(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: -17.561
InChIKey:FEXATKZHHDVBAG-UHFFFAOYSA-N
ID: 63011
SMILES:CC1=CC(c2c(O)cc(C)c(C=O)c2O)C(C(CCC(OC(=O)C)C(C)=C)(C)O)CC1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.524
CB1 binding score: -14.995
InChIKey:UGTPIFXVZRHMRF-UHFFFAOYSA-N
ID: 63012
SMILES:C1C(C)=CC2c3c(cc(CCCCC)c(C(=O)O)c3O)OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -19.351
InChIKey:UCONUSSAWGCZMV-UHFFFAOYSA-N
ID: 63013
SMILES:O(C)c1c(OC)c(C)c(Cl)c2c1C1C(C(C)(C)O2)CCC(C)(O)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.873
CB1 binding score: -15.737
InChIKey:BAIHBURLBZRGSY-UHFFFAOYSA-N
ID: 63014
SMILES:CCCCCC(c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC12)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.997
InChIKey:LWDBLQTYJUIETF-UHFFFAOYSA-N
ID: 63015
SMILES:C(Cc1ccccc1)CCCc1cc2c(c(O)c1)C1CC(C)(CCC3C(C)(C)O3)OC1CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.647
CB1 binding score: -17.488
InChIKey:JBYKUINLYQDFAA-UHFFFAOYSA-N
ID: 63016
SMILES:COC1c2c(cc(CCCCC)cc2O)OC(C)(CCC=C(C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -13.551
InChIKey:BZWJYKGFLVPZCL-UHFFFAOYSA-N
ID: 63017
SMILES:C1C(C)=CC(c2ccc(CCCCC)cc2)C(C(=C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.471
CB1 binding score: -19.804
InChIKey:VGBLUPCGCQUYRW-UHFFFAOYSA-N
ID: 63018
SMILES:C1(C)CC2c3c(O)cc(CCCCCC)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -18.766
InChIKey:OKXUDFJPZMVBEH-UHFFFAOYSA-N
ID: 63019
SMILES:CC1=CC2C(C(C)(C)Oc3c(C(O)C(=C)C)cc(C)c(O)c32)CCC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.698
InChIKey:MIXSWUFHFBBIJC-UHFFFAOYSA-N
ID: 63020
SMILES:C1(C)c2c(cc(C)c(O)c2)-c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.409
CB1 binding score: -16.197
InChIKey:OHDXBYOMIKYWHS-UHFFFAOYSA-N
ID: 63021
SMILES:O=C(Oc1c2c(cc(C)c1)OC(C)(C)C1CCC(C)=CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -16.714
InChIKey:DBLVECKZTGBPGL-UHFFFAOYSA-N